About 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide
3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide (PubChem CID 160991285) has the molecular formula C107H100N26O10S9
and a molecular weight of 2198.75 g/mol. Its IUPAC name is 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide.
Frequently Asked Questions
What is the IUPAC name of 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide?
The IUPAC name of 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide (CID 160991285) is 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide.
What is the SMILES notation for 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide?
The canonical SMILES for 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide is CC(=O)Nc1nc2c(ccc3sc(Nc4cc(C(N)=O)ccc4OC(C)C)nc32)[nH]1.CC(=O)c1cccc(Nc2nc3c(ccc4[nH]c(N)nc43)s2)c1.COc1ccccc1Nc1nc2c(ccc3[nH]c(NC(C)=O)nc32)s1.COc1ccccc1Nc1nc2c(s1)CCCc1nc(C)sc1-2.Cc1nc2ccc3sc(Nc4cc(C(N)=O)ccc4OC(C)C)nc3c2s1.Cc1nc2ccc3sc(Nc4ccccc4OC(C)C)nc3c2s1.
What is the InChIKey of 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide?
The InChIKey is TUQXPEOTDHDSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N6O3S.C19H18N4O2S2.C18H17N3OS2.C17H15N5O2S.C17H17N3OS2.C16H13N5OS/c1-9(2)29-14-6-4-11(18(21)28)8-13(14)24-20-26-17-15(30-20)7-5-12-16(17)25-19(23-12)22-10(3)27;1-9(2)25-14-6-4-11(18(20)24)8-13(14)22-19-23-16-15(27-19)7-5-12-17(16)26-10(3)21-12;1-10(2)22-14-7-5-4-6-12(14)20-18-21-16-15(24-18)9-8-13-17(16)23-11(3)19-13;1-9(23)18-16-19-11-7-8-13-15(14(11)21-16)22-17(25-13)20-10-5-3-4-6-12(10)24-2;1-10-18-12-7-5-9-14-15(16(12)22-10)20-17(23-14)19-11-6-3-4-8-13(11)21-2;1-8(22)9-3-2-4-10(7-9)18-16-21-14-12(23-16)6-5-11-13(14)20-15(17)19-11/h4-9H,1-3H3,(H2,21,28)(H,24,26)(H2,22,23,25,27);4-9H,1-3H3,(H2,20,24)(H,22,23);4-10H,1-3H3,(H,20,21);3-8H,1-2H3,(H,20,22)(H2,18,19,21,23);3-4,6,8H,5,7,9H2,1-2H3,(H,19,20);2-7H,1H3,(H,18,21)(H3,17,19,20).
What are the key properties of 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide?
3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide has a molecular weight of 2198.75 g/mol, XLogP of 26.75, 25 rotatable bonds, 14 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(7-acetamido-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]-4-propan-2-yloxybenzamide;1-[3-[(7-amino-6H-imidazo[4,5-e][1,3]benzothiazol-2-yl)amino]phenyl]ethanone;N-[2-(2-methoxyanilino)-6H-imidazo[4,5-e][1,3]benzothiazol-7-yl]acetamide;N-(2-methoxyphenyl)-4-methyl-3,11-dithia-5,13-diazatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,12-tetraen-12-amine;2-methyl-N-(2-propan-2-yloxyphenyl)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-amine;3-[(2-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-7-yl)amino]-4-propan-2-yloxybenzamide is sourced from PubChem (CID 160991285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).