2-(3-nitrophenyl)-4-pyridin-3-yl-2,3-dihydro-1,5-benzothiazepine

Systemtic Name: 2-(3-nitrophenyl)-4-pyridin-3-yl-2,3-dihydro-1,5-benzothiazepine Openeye Name: 2-(3-nitrophenyl)-4-(3-pyridyl)-2,3-dihydro-1,5-benzothiazepine CAS Name: 2-(3-nitrophenyl)-4-(3-pyridinyl)-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 2-(3-nitrophenyl)-4-pyridin-3-yl-2,3-dihydro-1,5-benzothiazepine Traditional Name: 2-(3-nitrophenyl)-4-(3-pyridyl)-2,3-dihydro-1,5-benzothiazepine Formula: C20H15N3O2S MolecularWeight: 361.417

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CN=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(SC2=CC=CC=C2N=C1C3=CN=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O2S/c24-23(25)16-7-3-5-14(11-16)20-12-18(15-6-4-10-21-13-15)22-17-8-1-2-9-19(17)26-20/h1-11,13,20H,12H2