(4S)-4-(3-nitrophenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione

Systemtic Name: (4S)-4-(3-nitrophenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione Openeye Name: (4S)-4-(3-nitrophenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione CAS Name: (4S)-4-(3-nitrophenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione IUPAC Name: (4S)-4-(3-nitrophenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione Traditional Name: (4S)-4-(3-nitrophenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C3=NC(=S)NC(C31)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2C3=NC(=S)N[C@@H](C31)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O2S/c22-21(23)13-6-3-5-12(10-13)16-15-9-8-11-4-1-2-7-14(11)17(15)20-18(24)19-16/h1-7,10,15-16H,8-9H2,(H,19,24)/t15?,16-/m1/s1