2-(3,4-dimethylphenyl)sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-(5-methyl-1H-pyrazol-3-yl)-4-quinazolinamine IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine Traditional Name: [2-[(3,4-dimethylphenyl)thio]quinazolin-4-yl]-(5-methyl-1H-pyrazol-3-yl)amine Formula: C20H19N5S MolecularWeight: 361.46336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C)C

InChI

InChI=1S/C20H19N5S/c1-12-8-9-15(10-13(12)2)26-20-21-17-7-5-4-6-16(17)19(23-20)22-18-11-14(3)24-25-18/h4-11H,1-3H3,(H2,21,22,23,24,25)