3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine

C119H123N27O11S6 — CID 158302505

About 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine

3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine (PubChem CID 158302505) has the molecular formula C119H123N27O11S6 and a molecular weight of 2299.87 g/mol. Its IUPAC name is 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine.

Molecular Properties

• Compound Name: 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine
• PubChem CID: 158302505
• Molecular Formula: C119H123N27O11S6
• Molecular Weight: 2299.87 g/mol
• Exact Mass: 2297.82
• IUPAC Name: 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine
• SMILES: CCCc1ccccc1Nc1nc2c(ccc3c2ncn3C)s1.CCCn1c(C)nc2c3nc(Nc4cc(C(N)=O)ccc4OC(C)C)sc3ccc21.CCn1c(C)nc2c3nc(Nc4cc(C(N)=O)ccc4OC(C)C)sc3ccc21.CCn1c(C)nc2ccc3sc(Nc4cc(C(N)=O)ccc4OC(C)C)nc3c21.COc1ccc(C(N)=O)cc1Nc1nc2c(ccc3c2ncn3C)s1.Cc1cc2ccc3sc(Nc4cc(C(N)=O)ccc4OC(C)C)nc3c2o1
• InChI: InChI=1S/C22H25N5O2S.2C21H23N5O2S.C20H19N3O3S.C18H18N4S.C17H15N5O2S/c1-5-10-27-13(4)24-19-16(27)7-9-18-20(19)26-22(30-18)25-15-11-14(21(23)28)6-8-17(15)29-12(2)3;1-5-26-12(4)23-18-15(26)7-9-17-19(18)25-21(29-17)24-14-10-13(20(22)27)6-8-16(14)28-11(2)3;1-5-26-12(4)23-14-7-9-17-18(19(14)26)25-21(29-17)24-15-10-13(20(22)27)6-8-16(15)28-11(2)3;1-10(2)25-15-6-4-13(19(21)24)9-14(15)22-20-23-17-16(27-20)7-5-12-8-11(3)26-18(12)17;1-3-6-12-7-4-5-8-13(12)20-18-21-17-15(23-18)10-9-14-16(17)19-11-22(14)2;1-22-8-19-14-11(22)4-6-13-15(14)21-17(25-13)20-10-7-9(16(18)23)3-5-12(10)24-2/h6-9,11-12H,5,10H2,1-4H3,(H2,23,28)(H,25,26);2*6-11H,5H2,1-4H3,(H2,22,27)(H,24,25);4-10H,1-3H3,(H2,21,24)(H,22,23);4-5,7-11H,3,6H2,1-2H3,(H,20,21);3-8H,1-2H3,(H2,18,23)(H,20,21)
• InChIKey: GMQYKCXBVRGGFX-UHFFFAOYSA-N
• XLogP: 27.10
• TPSA: 513.36 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 39
• Rotatable Bonds: 32
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2299.87
LogP ≤ 5	27.10
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	39

Frequently Asked Questions

What is the IUPAC name of 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine?

The IUPAC name of 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine (CID 158302505) is 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine.

What is the SMILES notation for 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine?

The canonical SMILES for 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine is CCCc1ccccc1Nc1nc2c(ccc3c2ncn3C)s1.CCCn1c(C)nc2c3nc(Nc4cc(C(N)=O)ccc4OC(C)C)sc3ccc21.CCn1c(C)nc2c3nc(Nc4cc(C(N)=O)ccc4OC(C)C)sc3ccc21.CCn1c(C)nc2ccc3sc(Nc4cc(C(N)=O)ccc4OC(C)C)nc3c21.COc1ccc(C(N)=O)cc1Nc1nc2c(ccc3c2ncn3C)s1.Cc1cc2ccc3sc(Nc4cc(C(N)=O)ccc4OC(C)C)nc3c2o1.

What is the InChIKey of 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine?

The InChIKey is GMQYKCXBVRGGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O2S.2C21H23N5O2S.C20H19N3O3S.C18H18N4S.C17H15N5O2S/c1-5-10-27-13(4)24-19-16(27)7-9-18-20(19)26-22(30-18)25-15-11-14(21(23)28)6-8-17(15)29-12(2)3;1-5-26-12(4)23-18-15(26)7-9-17-19(18)25-21(29-17)24-14-10-13(20(22)27)6-8-16(14)28-11(2)3;1-5-26-12(4)23-14-7-9-17-18(19(14)26)25-21(29-17)24-15-10-13(20(22)27)6-8-16(15)28-11(2)3;1-10(2)25-15-6-4-13(19(21)24)9-14(15)22-20-23-17-16(27-20)7-5-12-8-11(3)26-18(12)17;1-3-6-12-7-4-5-8-13(12)20-18-21-17-15(23-18)10-9-14-16(17)19-11-22(14)2;1-22-8-19-14-11(22)4-6-13-15(14)21-17(25-13)20-10-7-9(16(18)23)3-5-12(10)24-2/h6-9,11-12H,5,10H2,1-4H3,(H2,23,28)(H,25,26);2*6-11H,5H2,1-4H3,(H2,22,27)(H,24,25);4-10H,1-3H3,(H2,21,24)(H,22,23);4-5,7-11H,3,6H2,1-2H3,(H,20,21);3-8H,1-2H3,(H2,18,23)(H,20,21).

What are the key properties of 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine?

3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine has a molecular weight of 2299.87 g/mol, XLogP of 27.10, 32 rotatable bonds, 11 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[(6-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(8-ethyl-7-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;4-methoxy-3-[(6-methylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]benzamide;3-[(7-methylfuro[2,3-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;3-[(7-methyl-6-propylimidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;6-methyl-N-(2-propylphenyl)imidazo[4,5-e][1,3]benzothiazol-2-amine is sourced from PubChem (CID 158302505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).