2-[2-ethoxy-4-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)carbonyl]phenoxy]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-ethoxy-4-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)carbonyl]phenoxy]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-ethoxy-4-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)phenoxy]-1-(1-piperidyl)ethanone CAS Name: 2-[2-ethoxy-4-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-oxomethyl]phenoxy]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-ethoxy-4-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)phenoxy]-1-piperidin-1-ylethanone Traditional Name: 2-[2-ethoxy-4-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl)phenoxy]-1-piperidino-ethanone Formula: C26H32N2O4S MolecularWeight: 468.60828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCC(SC3=CC=CC=C32)C)OCC(=O)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCC(SC3=CC=CC=C32)C)OCC(=O)N4CCCCC4

InChI

InChI=1S/C26H32N2O4S/c1-3-31-23-17-20(11-12-22(23)32-18-25(29)27-14-7-4-8-15-27)26(30)28-16-13-19(2)33-24-10-6-5-9-21(24)28/h5-6,9-12,17,19H,3-4,7-8,13-16,18H2,1-2H3