9-methoxy-4-(3-nitrophenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione

Systemtic Name: 9-methoxy-4-(3-nitrophenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione Openeye Name: 9-methoxy-4-(3-nitrophenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione CAS Name: 9-methoxy-4-(3-nitrophenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione IUPAC Name: 9-methoxy-4-(3-nitrophenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione Traditional Name: 9-methoxy-4-(3-nitrophenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC3=C2NC(=S)NC3C4=CC(=CC=C4)[N+](=O)[O-])C=C1

Isomeric SMILES

COC1=CC2=C(CCC3=C2NC(=S)NC3C4=CC(=CC=C4)[N+](=O)[O-])C=C1

InChI

InChI=1S/C19H17N3O3S/c1-25-14-7-5-11-6-8-15-17(12-3-2-4-13(9-12)22(23)24)20-19(26)21-18(15)16(11)10-14/h2-5,7,9-10,17H,6,8H2,1H3,(H2,20,21,26)