N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-2-yl)-2-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-2-yl)-2-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-2-yl)-2-(p-tolylsulfonylamino)propanamide CAS Name: N-(5-methyl-6-oxo-2-benzo[b][1,4]benzothiazepinyl)-2-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-2-yl)-2-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-2-yl)-2-(tosylamino)propionamide Formula: C24H23N3O4S2 MolecularWeight: 481.58712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NC2=CC3=C(C=C2)N(C(=O)C4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NC2=CC3=C(C=C2)N(C(=O)C4=CC=CC=C4S3)C

InChI

InChI=1S/C24H23N3O4S2/c1-15-8-11-18(12-9-15)33(30,31)26-16(2)23(28)25-17-10-13-20-22(14-17)32-21-7-5-4-6-19(21)24(29)27(20)3/h4-14,16,26H,1-3H3,(H,25,28)