5-ethanoyl-6-methyl-2-sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-6-methyl-2-sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-6-methyl-2-sulfanyl-4-(2-thienyl)-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-2-mercapto-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-6-methyl-2-sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-2-mercapto-6-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carbonitrile Formula: C13H12N2OS2 MolecularWeight: 276.37718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)S)C#N)C2=CC=CS2)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)S)C#N)C2=CC=CS2)C(=O)C

InChI

InChI=1S/C13H12N2OS2/c1-7-11(8(2)16)12(10-4-3-5-18-10)9(6-14)13(17)15-7/h3-5,12,15,17H,1-2H3