2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[(2,4-dimethylphenyl)carbamoyl]ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[(2,4-dimethylphenyl)carbamoyl]ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[(2,4-dimethylphenyl)carbamoyl]acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[(2,4-dimethylanilino)-oxomethyl]acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[(2,4-dimethylphenyl)carbamoyl]acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-N-[(2,4-dimethylphenyl)carbamoyl]acetamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)CN2CCCSC3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)CN2CCCSC3=CC=CC=C32)C

InChI

InChI=1S/C20H23N3O2S/c1-14-8-9-16(15(2)12-14)21-20(25)22-19(24)13-23-10-5-11-26-18-7-4-3-6-17(18)23/h3-4,6-9,12H,5,10-11,13H2,1-2H3,(H2,21,22,24,25)