4-(4-chlorophenyl)-5-ethanoyl-6-methyl-3-prop-2-enyl-2-sulfanylidene-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-5-ethanoyl-6-methyl-3-prop-2-enyl-2-sulfanylidene-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-3-allyl-4-(4-chlorophenyl)-6-methyl-2-thioxo-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(4-chlorophenyl)-6-methyl-3-prop-2-enyl-2-sulfanylidene-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(4-chlorophenyl)-6-methyl-3-prop-2-enyl-2-sulfanylidene-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-3-allyl-4-(4-chlorophenyl)-6-methyl-2-thioxo-1,4-dihydropyridine-3-carbonitrile Formula: C18H17ClN2OS MolecularWeight: 344.85838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(C(=S)N1)(CC=C)C#N)C2=CC=C(C=C2)Cl)C(=O)C

Isomeric SMILES

CC1=C(C(C(C(=S)N1)(CC=C)C#N)C2=CC=C(C=C2)Cl)C(=O)C

InChI

InChI=1S/C18H17ClN2OS/c1-4-9-18(10-20)16(13-5-7-14(19)8-6-13)15(12(3)22)11(2)21-17(18)23/h4-8,16H,1,9H2,2-3H3,(H,21,23)