1-methyl-2-[(4-methylphenyl)methylamino]-6-oxidanylidene-4-thiophen-2-yl-pyrimidine-5-carbonitrile

Systemtic Name: 1-methyl-2-[(4-methylphenyl)methylamino]-6-oxidanylidene-4-thiophen-2-yl-pyrimidine-5-carbonitrile Openeye Name: 1-methyl-6-oxo-2-(p-tolylmethylamino)-4-(2-thienyl)pyrimidine-5-carbonitrile CAS Name: 1-methyl-2-[(4-methylphenyl)methylamino]-6-oxo-4-thiophen-2-yl-5-pyrimidinecarbonitrile IUPAC Name: 1-methyl-2-[(4-methylphenyl)methylamino]-6-oxo-4-thiophen-2-ylpyrimidine-5-carbonitrile Traditional Name: 6-keto-1-methyl-2-[(4-methylbenzyl)amino]-4-(2-thienyl)pyrimidine-5-carbonitrile Formula: C18H16N4OS MolecularWeight: 336.41084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC(=C(C(=O)N2C)C#N)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC(=C(C(=O)N2C)C#N)C3=CC=CS3

InChI

InChI=1S/C18H16N4OS/c1-12-5-7-13(8-6-12)11-20-18-21-16(15-4-3-9-24-15)14(10-19)17(23)22(18)2/h3-9H,11H2,1-2H3,(H,20,21)