N-(5-acetamido-2-methoxy-phenyl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CN2CCCSC3=CC=CC=C32

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CN2CCCSC3=CC=CC=C32

InChI

InChI=1S/C20H23N3O3S/c1-14(24)21-15-8-9-18(26-2)16(12-15)22-20(25)13-23-10-5-11-27-19-7-4-3-6-17(19)23/h3-4,6-9,12H,5,10-11,13H2,1-2H3,(H,21,24)(H,22,25)