4-imidazo[2,1-b][1,3]benzothiazol-2-ylcarbonyl-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-imidazo[2,1-b][1,3]benzothiazol-2-ylcarbonyl-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[2-imidazo[2,1-b][1,3]benzothiazolyl(oxo)methyl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Formula: C23H23N5O3S MolecularWeight: 449.52542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)N2CCCN(CC2)C(=O)C3=CN4C5=CC=CC=C5SC4=N3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)N2CCCN(CC2)C(=O)C3=CN4C5=CC=CC=C5SC4=N3

InChI

InChI=1S/C23H23N5O3S/c1-31-19-9-4-2-7-16(19)24-22(30)27-12-6-11-26(13-14-27)21(29)17-15-28-18-8-3-5-10-20(18)32-23(28)25-17/h2-5,7-10,15H,6,11-14H2,1H3,(H,24,30)