N-[2-[[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]amino]phenyl]benzamide

Systemtic Name: N-[2-[[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]amino]phenyl]benzamide Openeye Name: N-[2-[[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethyl]amino]phenyl]benzamide CAS Name: N-[2-[[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]amino]phenyl]benzamide IUPAC Name: N-[2-[[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]amino]phenyl]benzamide Traditional Name: N-[2-[[2-keto-2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]amino]phenyl]benzamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CNC3=CC=CC=C3NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CNC3=CC=CC=C3NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O2S/c1-18-15-16-28(22-13-7-8-14-23(22)31-18)24(29)17-26-20-11-5-6-12-21(20)27-25(30)19-9-3-2-4-10-19/h2-14,18,26H,15-17H2,1H3,(H,27,30)