4-bromanyl-N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxidanylidene-propyl]benzamide Openeye Name: 4-bromo-N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxo-propyl]benzamide CAS Name: 4-bromo-N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxopropyl]benzamide IUPAC Name: 4-bromo-N-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxopropyl]benzamide Traditional Name: 4-bromo-N-[3-keto-3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propyl]benzamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H21BrN2O2S/c1-14-11-13-23(17-4-2-3-5-18(17)26-14)19(24)10-12-22-20(25)15-6-8-16(21)9-7-15/h2-9,14H,10-13H2,1H3,(H,22,25)