4-(4-nitrophenyl)-2-sulfanylidene-5,6-dihydro-3H-benzo[f]isoquinoline-1-carbonitrile

Systemtic Name: 4-(4-nitrophenyl)-2-sulfanylidene-5,6-dihydro-3H-benzo[f]isoquinoline-1-carbonitrile Openeye Name: 4-(4-nitrophenyl)-2-thioxo-5,6-dihydro-3H-benzo[f]isoquinoline-1-carbonitrile CAS Name: 4-(4-nitrophenyl)-2-sulfanylidene-5,6-dihydro-3H-benzo[f]isoquinoline-1-carbonitrile IUPAC Name: 4-(4-nitrophenyl)-2-sulfanylidene-5,6-dihydro-3H-benzo[f]isoquinoline-1-carbonitrile Traditional Name: 4-(4-nitrophenyl)-2-thioxo-5,6-dihydro-3H-benz[f]isoquinoline-1-carbonitrile Formula: C20H13N3O2S MolecularWeight: 359.40112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13N3O2S/c21-11-17-18-15-4-2-1-3-12(15)7-10-16(18)19(22-20(17)26)13-5-8-14(9-6-13)23(24)25/h1-6,8-9H,7,10H2,(H,22,26)