22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine

C120H113N31O5S — CID 164960320

About 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine

22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine (PubChem CID 164960320) has the molecular formula C120H113N31O5S and a molecular weight of 2101.50 g/mol. Its IUPAC name is 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine.

Molecular Properties

• Compound Name: 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine
• PubChem CID: 164960320
• Molecular Formula: C120H113N31O5S
• Molecular Weight: 2101.50 g/mol
• Exact Mass: 2099.93
• IUPAC Name: 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine
• SMILES: CCn1ncc2c1-c1cnc(N)c(c1)OC(C)c1cc(C)ccc1-c1nn(C)c(C)c1C2.Cc1ccc2c(c1)C(C)Oc1cc(cnc1N)-c1c(C#N)ncn1Cc1ccnn1-2.Cc1ccc2c(c1)C(C)Oc1cc(cnc1N)-c1c(C#N)nn(C)c1Cc1sc(C)nc1-2.Cc1ccc2c(c1)C(C)Oc1cc(cnc1N)C1=C(Cc3cc(C)nn3-2)C(C)N=C1C#N.Cc1ccc2c(c1)COc1cc(cnc1N)-c1c(C#N)nn(C)c1Cc1cccnc1-2
• InChI: InChI=1S/C25H24N6O.C25H28N6O.C24H22N6OS.C24H20N6O.C22H19N7O/c1-13-5-6-22-20(7-13)16(4)32-23-9-17(12-28-25(23)27)24-19(15(3)29-21(24)11-26)10-18-8-14(2)30-31(18)22;1-6-31-24-17(13-28-31)10-20-15(3)30(5)29-23(20)19-8-7-14(2)9-21(19)16(4)32-22-11-18(24)12-27-25(22)26;1-12-5-6-16-17(7-12)13(2)31-20-8-15(11-27-24(20)26)22-18(10-25)29-30(4)19(22)9-21-23(16)28-14(3)32-21;1-14-5-6-18-17(8-14)13-31-21-10-16(12-28-24(21)26)22-19(11-25)29-30(2)20(22)9-15-4-3-7-27-23(15)18;1-13-3-4-19-17(7-13)14(2)30-20-8-15(10-25-22(20)24)21-18(9-23)26-12-28(21)11-16-5-6-27-29(16)19/h5-9,12,15-16H,10H2,1-4H3,(H2,27,28);7-9,11-13,16H,6,10H2,1-5H3,(H2,26,27);5-8,11,13H,9H2,1-4H3,(H2,26,27);3-8,10,12H,9,13H2,1-2H3,(H2,26,28);3-8,10,12,14H,11H2,1-2H3,(H2,24,25)
• InChIKey: BTDBSGJKZKUVPA-UHFFFAOYSA-N
• XLogP: 20.80
• TPSA: 498.74 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 37
• Rotatable Bonds: 1
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2101.50
LogP ≤ 5	20.80
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_OC_no_alk_C(3)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine?

The IUPAC name of 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine (CID 164960320) is 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine.

What is the SMILES notation for 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine?

The canonical SMILES for 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine is CCn1ncc2c1-c1cnc(N)c(c1)OC(C)c1cc(C)ccc1-c1nn(C)c(C)c1C2.Cc1ccc2c(c1)C(C)Oc1cc(cnc1N)-c1c(C#N)ncn1Cc1ccnn1-2.Cc1ccc2c(c1)C(C)Oc1cc(cnc1N)-c1c(C#N)nn(C)c1Cc1sc(C)nc1-2.Cc1ccc2c(c1)C(C)Oc1cc(cnc1N)C1=C(Cc3cc(C)nn3-2)C(C)N=C1C#N.Cc1ccc2c(c1)COc1cc(cnc1N)-c1c(C#N)nn(C)c1Cc1cccnc1-2.

What is the InChIKey of 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine?

The InChIKey is BTDBSGJKZKUVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O.C25H28N6O.C24H22N6OS.C24H20N6O.C22H19N7O/c1-13-5-6-22-20(7-13)16(4)32-23-9-17(12-28-25(23)27)24-19(15(3)29-21(24)11-26)10-18-8-14(2)30-31(18)22;1-6-31-24-17(13-28-31)10-20-15(3)30(5)29-23(20)19-8-7-14(2)9-21(19)16(4)32-22-11-18(24)12-27-25(22)26;1-12-5-6-16-17(7-12)13(2)31-20-8-15(11-27-24(20)26)22-18(10-25)29-30(4)19(22)9-21-23(16)28-14(3)32-21;1-14-5-6-18-17(8-14)13-31-21-10-16(12-28-24(21)26)22-19(11-25)29-30(2)20(22)9-15-4-3-7-27-23(15)18;1-13-3-4-19-17(7-13)14(2)30-20-8-15(10-25-22(20)24)21-18(9-23)26-12-28(21)11-16-5-6-27-29(16)19/h5-9,12,15-16H,10H2,1-4H3,(H2,27,28);7-9,11-13,16H,6,10H2,1-5H3,(H2,26,27);5-8,11,13H,9H2,1-4H3,(H2,26,27);3-8,10,12H,9,13H2,1-2H3,(H2,26,28);3-8,10,12,14H,11H2,1-2H3,(H2,24,25).

What are the key properties of 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine?

22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine has a molecular weight of 2101.50 g/mol, XLogP of 20.80, 1 rotatable bonds, 5 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 22-amino-16,19-dimethyl-20-oxa-4,6,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2,4,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;23-amino-5,17-dimethyl-21-oxa-4,5,12,24-tetrazapentacyclo[20.3.1.02,6.08,13.014,19]hexacosa-1(26),2(6),3,8(13),9,11,14(19),15,17,22,24-undecaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-4,11,12,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8,10,13(18),14,16,21,23-decaene-3-carbonitrile;22-amino-5,10,16,19-tetramethyl-20-oxa-9-thia-4,5,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),3,8(12),10,13(18),14,16,21,23-decaene-3-carbonitrile;3-ethyl-9,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine is sourced from PubChem (CID 164960320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).