4-(2-nitrophenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile

Systemtic Name: 4-(2-nitrophenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Openeye Name: 4-(2-nitrophenyl)-2-thioxo-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile CAS Name: 4-(2-nitrophenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile IUPAC Name: 4-(2-nitrophenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Traditional Name: 4-(2-nitrophenyl)-2-thioxo-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=S)N2)C#N)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=S)N2)C#N)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O2S/c17-9-12-15(11-6-2-4-8-14(11)19(20)21)10-5-1-3-7-13(10)18-16(12)22/h2,4,6,8H,1,3,5,7H2,(H,18,22)