2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-oxidanylideneazepan-3-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-oxidanylideneazepan-3-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-oxoazepan-3-yl)thiazole-4-carboxamide CAS Name: 2-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(2-oxo-3-azepanyl)-4-thiazolecarboxamide IUPAC Name: 2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(2-oxoazepan-3-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-(2-ketoazepan-3-yl)-2-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]thiazole-4-carboxamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=N2)SCC3=NC(=CS3)C(=O)NC4CCCCNC4=O

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=N2)SCC3=NC(=CS3)C(=O)NC4CCCCNC4=O

InChI

InChI=1S/C19H20N4O3S2/c1-11-5-4-7-14-16(11)23-19(26-14)28-10-15-21-13(9-27-15)18(25)22-12-6-2-3-8-20-17(12)24/h4-5,7,9,12H,2-3,6,8,10H2,1H3,(H,20,24)(H,22,25)