5-ethanoyl-4-(furan-2-yl)-6-methyl-2-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-4-(furan-2-yl)-6-methyl-2-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(2-furyl)-6-methyl-2-[2-(4-nitrophenyl)-2-oxo-ethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(2-furanyl)-6-methyl-2-[[2-(4-nitrophenyl)-2-oxoethyl]thio]-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(furan-2-yl)-6-methyl-2-[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(2-furyl)-2-[[2-keto-2-(4-nitrophenyl)ethyl]thio]-6-methyl-1,4-dihydropyridine-3-carbonitrile Formula: C21H17N3O5S MolecularWeight: 423.44178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C#N)C3=CC=CO3)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C#N)C3=CC=CO3)C(=O)C

InChI

InChI=1S/C21H17N3O5S/c1-12-19(13(2)25)20(18-4-3-9-29-18)16(10-22)21(23-12)30-11-17(26)14-5-7-15(8-6-14)24(27)28/h3-9,20,23H,11H2,1-2H3