N-[[3-[[4-(2-azanyl-4-methyl-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]phenyl]methyl]methanesulfonamide

Systemtic Name: N-[[3-[[4-(2-azanyl-4-methyl-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]phenyl]methyl]methanesulfonamide Openeye Name: N-[[3-[[4-(2-amino-4-methyl-thiazol-5-yl)pyrimidin-2-yl]amino]phenyl]methyl]methanesulfonamide CAS Name: N-[[3-[[4-(2-amino-4-methyl-5-thiazolyl)-2-pyrimidinyl]amino]phenyl]methyl]methanesulfonamide IUPAC Name: N-[[3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]phenyl]methyl]methanesulfonamide Traditional Name: N-[3-[[4-(2-amino-4-methyl-thiazol-5-yl)pyrimidin-2-yl]amino]benzyl]methanesulfonamide Formula: C16H18N6O2S2 MolecularWeight: 390.48312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)C2=NC(=NC=C2)NC3=CC=CC(=C3)CNS(=O)(=O)C

Isomeric SMILES

CC1=C(SC(=N1)N)C2=NC(=NC=C2)NC3=CC=CC(=C3)CNS(=O)(=O)C

InChI

InChI=1S/C16H18N6O2S2/c1-10-14(25-15(17)20-10)13-6-7-18-16(22-13)21-12-5-3-4-11(8-12)9-19-26(2,23)24/h3-8,19H,9H2,1-2H3,(H2,17,20)(H,18,21,22)