2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoylamino]-N-(2-methoxy-5-methyl-phenyl)ethanamide

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoylamino]-N-(2-methoxy-5-methyl-phenyl)ethanamide Openeye Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-N-(2-methoxy-5-methyl-phenyl)acetamide CAS Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-oxoethyl]amino]-N-(2-methoxy-5-methylphenyl)acetamide IUPAC Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-N-(2-methoxy-5-methylphenyl)acetamide Traditional Name: 2-[[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]amino]-N-(2-methoxy-5-methyl-phenyl)acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3S/c1-15-8-9-18(27-2)16(12-15)23-20(25)13-22-21(26)14-24-10-5-11-28-19-7-4-3-6-17(19)24/h3-4,6-9,12H,5,10-11,13-14H2,1-2H3,(H,22,26)(H,23,25)