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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=CC(S2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C[C@H](S2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

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/h1-12,19-20H/t19-/m0/s1