6-(4-methylphenyl)-3-pentyl-2,4-bis(sulfanylidene)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-methylphenyl)-3-pentyl-2,4-bis(sulfanylidene)-1H-pyrimidine-5-carbonitrile Openeye Name: 3-pentyl-6-(p-tolyl)-2,4-dithioxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-methylphenyl)-3-pentyl-2,4-bis(sulfanylidene)-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-methylphenyl)-3-pentyl-2,4-bis(sulfanylidene)-1H-pyrimidine-5-carbonitrile Traditional Name: 3-amyl-6-(p-tolyl)-2,4-dithioxo-1H-pyrimidine-5-carbonitrile Formula: C17H19N3S2 MolecularWeight: 329.48286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=S)C(=C(NC1=S)C2=CC=C(C=C2)C)C#N

Isomeric SMILES

CCCCCN1C(=S)C(=C(NC1=S)C2=CC=C(C=C2)C)C#N

InChI

InChI=1S/C17H19N3S2/c1-3-4-5-10-20-16(21)14(11-18)15(19-17(20)22)13-8-6-12(2)7-9-13/h6-9H,3-5,10H2,1-2H3,(H,19,22)