7-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 7-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 7-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 7-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-oxomethyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 7-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 7-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C23H21N3O2S MolecularWeight: 403.49674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CNC3=CC=CC=C32)C(=O)C4=CC5=C(C=C4)SCCC(=O)N5

Isomeric SMILES

C1CN(CC=C1C2=CNC3=CC=CC=C32)C(=O)C4=CC5=C(C=C4)SCCC(=O)N5

InChI

InChI=1S/C23H21N3O2S/c27-22-9-12-29-21-6-5-16(13-20(21)25-22)23(28)26-10-7-15(8-11-26)18-14-24-19-4-2-1-3-17(18)19/h1-7,13-14,24H,8-12H2,(H,25,27)