2-[di(propan-2-yl)amino]-7-methylsulfanyl-3-phenyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile

Systemtic Name: 2-[di(propan-2-yl)amino]-7-methylsulfanyl-3-phenyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Openeye Name: 2-(diisopropylamino)-7-methylsulfanyl-3-phenyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile CAS Name: 2-[di(propan-2-yl)amino]-7-(methylthio)-3-phenyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile IUPAC Name: 2-[di(propan-2-yl)amino]-7-methylsulfanyl-3-phenyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Traditional Name: 2-(diisopropylamino)-7-(methylthio)-3-phenyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Formula: C21H25N5S MolecularWeight: 379.5217

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=NC2=C(C(=NC=C2CN1C3=CC=CC=C3)SC)C#N)C(C)C

Isomeric SMILES

CC(C)N(C1=NC2=C(C(=NC=C2CN1C3=CC=CC=C3)SC)C#N)C(C)C

InChI

InChI=1S/C21H25N5S/c1-14(2)26(15(3)4)21-24-19-16(12-23-20(27-5)18(19)11-22)13-25(21)17-9-7-6-8-10-17/h6-10,12,14-15H,13H2,1-5H3