4-(5-butylthiophen-2-yl)-6-(3-nitrophenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 4-(5-butylthiophen-2-yl)-6-(3-nitrophenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 4-(5-butyl-2-thienyl)-6-(3-nitrophenyl)-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 4-(5-butyl-2-thiophenyl)-6-(3-nitrophenyl)-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 4-(5-butylthiophen-2-yl)-6-(3-nitrophenyl)-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 4-(5-butyl-2-thienyl)-2-keto-6-(3-nitrophenyl)-1H-pyridine-3-carbonitrile Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(S1)C2=C(C(=O)NC(=C2)C3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CCCCC1=CC=C(S1)C2=C(C(=O)NC(=C2)C3=CC(=CC=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H17N3O3S/c1-2-3-7-15-8-9-19(27-15)16-11-18(22-20(24)17(16)12-21)13-5-4-6-14(10-13)23(25)26/h4-6,8-11H,2-3,7H2,1H3,(H,22,24)