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

Systemtic Name: 2-(3-nitrophenyl)-4-thiophen-2-yl-2,3-dihydro-1,5-benzothiazepine Openeye Name: 2-(3-nitrophenyl)-4-(2-thienyl)-2,3-dihydro-1,5-benzothiazepine CAS Name: 2-(3-nitrophenyl)-4-thiophen-2-yl-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 2-(3-nitrophenyl)-4-thiophen-2-yl-2,3-dihydro-1,5-benzothiazepine Traditional Name: 2-(3-nitrophenyl)-4-(2-thienyl)-2,3-dihydro-1,5-benzothiazepine Formula: C19H14N2O2S2 MolecularWeight: 366.45666

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CC=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(SC2=CC=CC=C2N=C1C3=CC=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N2O2S2/c22-21(23)14-6-3-5-13(11-14)19-12-16(17-9-4-10-24-17)20-15-7-1-2-8-18(15)25-19/h1-11,19H,12H2