2,3-dihydroindol-1-yl-(8-methyl-6-propyl-benzo[b][1,4]benzothiazepin-3-yl)methanone

Systemtic Name: 2,3-dihydroindol-1-yl-(8-methyl-6-propyl-benzo[b][1,4]benzothiazepin-3-yl)methanone Openeye Name: indolin-1-yl-(8-methyl-6-propyl-benzo[b][1,4]benzothiazepin-3-yl)methanone CAS Name: 2,3-dihydroindol-1-yl-(8-methyl-6-propyl-3-benzo[b][1,4]benzothiazepinyl)methanone IUPAC Name: 2,3-dihydroindol-1-yl-(8-methyl-6-propylbenzo[b][1,4]benzothiazepin-3-yl)methanone Traditional Name: indolin-1-yl-(8-methyl-6-propyl-benzo[b][1,4]benzothiazepin-3-yl)methanone Formula: C26H24N2OS MolecularWeight: 412.54656

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC(=C2)C(=O)N3CCC4=CC=CC=C43)SC5=C1C=C(C=C5)C

Isomeric SMILES

CCCC1=NC2=C(C=CC(=C2)C(=O)N3CCC4=CC=CC=C43)SC5=C1C=C(C=C5)C

InChI

InChI=1S/C26H24N2OS/c1-3-6-21-20-15-17(2)9-11-24(20)30-25-12-10-19(16-22(25)27-21)26(29)28-14-13-18-7-4-5-8-23(18)28/h4-5,7-12,15-16H,3,6,13-14H2,1-2H3