(Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole

C191H192N12O7S9 — CID 157206016

About (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole

(Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole (PubChem CID 157206016) has the molecular formula C191H192N12O7S9 and a molecular weight of 3056.32 g/mol. Its IUPAC name is (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole.

Molecular Properties

• Compound Name: (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole
• PubChem CID: 157206016
• Molecular Formula: C191H192N12O7S9
• Molecular Weight: 3056.32 g/mol
• Exact Mass: 3053.25
• IUPAC Name: (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole
• SMILES: CCCCCCCCN1C(=O)/C(=c2\s/c(=C\c3ccc(/C=C/c4c(-c5ccc(OC)cc5)c(C)c5ccccn45)s3)c(=O)n2CC)SC1=S.CCCCCCOc1ccc(-c2ccc(-c3c(CC(CC)CCCC)c4cc(-c5ccc(C)cc5OCCCCCC)ccn4c3-c3cc4c(s3)-c3sc(/C=C(/C)C#N)cc3C4(C)C)cc2)c(OCCCCCC)c1.COc1ccc(-c2c(C)c3ccccn3c2/C=C/c2ccc(/C=C(/C)C#N)s2)cc1.Cc1ccc(-c2ccc(/C=C/c3c(-c4ccccc4)c(C)c4ccccn34)c3nsnc23)cc1.Cc1ccc2c(c1)N=C(c1ccc(-c3c(-c4ccccc4)c(C)c4ccccn34)s1)C2
• InChI: InChI=1S/C68H84N2O3S2.C39H41N3O3S4.C30H23N3S.C28H22N2S.C26H22N2OS/c1-10-15-19-22-36-71-53-31-33-55(62(43-53)73-38-24-21-17-12-3)50-27-29-51(30-28-50)64-57(41-49(14-5)25-18-13-4)60-42-52(56-32-26-47(6)40-61(56)72-37-23-20-16-11-2)34-35-70(60)65(64)63-45-59-67(75-63)66-58(68(59,8)9)44-54(74-66)39-48(7)46-69;1-5-7-8-9-10-12-24-42-37(44)35(49-39(42)46)38-40(6-2)36(43)33(48-38)25-30-20-19-29(47-30)21-22-32-34(27-15-17-28(45-4)18-16-27)26(3)31-14-11-13-23-41(31)32;1-20-11-13-22(14-12-20)25-17-15-24(29-30(25)32-34-31-29)16-18-27-28(23-8-4-3-5-9-23)21(2)26-10-6-7-19-33(26)27;1-18-11-12-21-17-23(29-22(21)16-18)25-13-14-26(31-25)28-27(20-8-4-3-5-9-20)19(2)24-10-6-7-15-30(24)28;1-18(17-27)16-23-12-11-22(30-23)13-14-25-26(20-7-9-21(29-3)10-8-20)19(2)24-6-4-5-15-28(24)25/h26-35,39-40,42-45,49H,10-25,36-38,41H2,1-9H3;11,13-23,25H,5-10,12,24H2,1-4H3;3-19H,1-2H3;3-16H,17H2,1-2H3;4-16H,1-3H3/b48-39-;22-21+,33-25-,38-35+;18-16+;;14-13+,18-16-
• InChIKey: ARJFCKRJNNECIS-JENPSXFXSA-N
• XLogP: 52.24
• TPSA: 196.23 Ų
• H-Bond Acceptors: 27
• Rotatable Bonds: 54
• Heavy Atoms: 219
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3056.32
LogP ≤ 5	52.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'ene_rhod_A(235)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'conjugated_nitrile_group', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole?

The IUPAC name of (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole (CID 157206016) is (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole.

What is the SMILES notation for (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole?

The canonical SMILES for (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole is CCCCCCCCN1C(=O)/C(=c2\s/c(=C\c3ccc(/C=C/c4c(-c5ccc(OC)cc5)c(C)c5ccccn45)s3)c(=O)n2CC)SC1=S.CCCCCCOc1ccc(-c2ccc(-c3c(CC(CC)CCCC)c4cc(-c5ccc(C)cc5OCCCCCC)ccn4c3-c3cc4c(s3)-c3sc(/C=C(/C)C#N)cc3C4(C)C)cc2)c(OCCCCCC)c1.COc1ccc(-c2c(C)c3ccccn3c2/C=C/c2ccc(/C=C(/C)C#N)s2)cc1.Cc1ccc(-c2ccc(/C=C/c3c(-c4ccccc4)c(C)c4ccccn34)c3nsnc23)cc1.Cc1ccc2c(c1)N=C(c1ccc(-c3c(-c4ccccc4)c(C)c4ccccn34)s1)C2.

What is the InChIKey of (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole?

The InChIKey is ARJFCKRJNNECIS-JENPSXFXSA-N. The full InChI is InChI=1S/C68H84N2O3S2.C39H41N3O3S4.C30H23N3S.C28H22N2S.C26H22N2OS/c1-10-15-19-22-36-71-53-31-33-55(62(43-53)73-38-24-21-17-12-3)50-27-29-51(30-28-50)64-57(41-49(14-5)25-18-13-4)60-42-52(56-32-26-47(6)40-61(56)72-37-23-20-16-11-2)34-35-70(60)65(64)63-45-59-67(75-63)66-58(68(59,8)9)44-54(74-66)39-48(7)46-69;1-5-7-8-9-10-12-24-42-37(44)35(49-39(42)46)38-40(6-2)36(43)33(48-38)25-30-20-19-29(47-30)21-22-32-34(27-15-17-28(45-4)18-16-27)26(3)31-14-11-13-23-41(31)32;1-20-11-13-22(14-12-20)25-17-15-24(29-30(25)32-34-31-29)16-18-27-28(23-8-4-3-5-9-23)21(2)26-10-6-7-19-33(26)27;1-18-11-12-21-17-23(29-22(21)16-18)25-13-14-26(31-25)28-27(20-8-4-3-5-9-20)19(2)24-10-6-7-15-30(24)28;1-18(17-27)16-23-12-11-22(30-23)13-14-25-26(20-7-9-21(29-3)10-8-20)19(2)24-6-4-5-15-28(24)25/h26-35,39-40,42-45,49H,10-25,36-38,41H2,1-9H3;11,13-23,25H,5-10,12,24H2,1-4H3;3-19H,1-2H3;3-16H,17H2,1-2H3;4-16H,1-3H3/b48-39-;22-21+,33-25-,38-35+;18-16+;;14-13+,18-16-.

What are the key properties of (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole?

(Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole has a molecular weight of 3056.32 g/mol, XLogP of 52.24, 54 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for (Z)-3-[10-[2-[4-(2,4-dihexoxyphenyl)phenyl]-1-(2-ethylhexyl)-7-(2-hexoxy-4-methylphenyl)indolizin-3-yl]-7,7-dimethyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-2-methylprop-2-enenitrile;(2E,5Z)-3-ethyl-5-[[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]methylidene]-2-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-thiazolidin-4-one;(Z)-3-[5-[(E)-2-[2-(4-methoxyphenyl)-1-methylindolizin-3-yl]ethenyl]thiophen-2-yl]-2-methylprop-2-enenitrile;1-methyl-3-[5-(6-methyl-3H-indol-2-yl)thiophen-2-yl]-2-phenylindolizine;4-(4-methylphenyl)-7-[(E)-2-(1-methyl-2-phenylindolizin-3-yl)ethenyl]-2,1,3-benzothiadiazole is sourced from PubChem (CID 157206016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).