1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]-N-propan-2-yl-3,4-dihydro-2H-quinoline-5-carboxamide

Systemtic Name: 1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]-N-propan-2-yl-3,4-dihydro-2H-quinoline-5-carboxamide Openeye Name: N-isopropyl-1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethyl]-3,4-dihydro-2H-quinoline-5-carboxamide CAS Name: 1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]-N-propan-2-yl-3,4-dihydro-2H-quinoline-5-carboxamide IUPAC Name: 1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]-N-propan-2-yl-3,4-dihydro-2H-quinoline-5-carboxamide Traditional Name: N-isopropyl-1-[2-keto-2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]-3,4-dihydro-2H-quinoline-5-carboxamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CN3CCCC4=C(C=CC=C43)C(=O)NC(C)C

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CN3CCCC4=C(C=CC=C43)C(=O)NC(C)C

InChI

InChI=1S/C25H31N3O2S/c1-17(2)26-25(30)20-8-6-11-21-19(20)9-7-14-27(21)16-24(29)28-15-13-18(3)31-23-12-5-4-10-22(23)28/h4-6,8,10-12,17-18H,7,9,13-16H2,1-3H3,(H,26,30)