6-chloranyl-N2,N4-dimethyl-N4-[1-(phenylmethyl)piperidin-4-yl]-5-phenylsulfanyl-pyrimidine-2,4-diamine

Systemtic Name: 6-chloranyl-N2,N4-dimethyl-N4-[1-(phenylmethyl)piperidin-4-yl]-5-phenylsulfanyl-pyrimidine-2,4-diamine Openeye Name: N4-(1-benzyl-4-piperidyl)-6-chloro-N2,N4-dimethyl-5-phenylsulfanyl-pyrimidine-2,4-diamine CAS Name: 6-chloro-N2,N4-dimethyl-N4-[1-(phenylmethyl)-4-piperidinyl]-5-(phenylthio)pyrimidine-2,4-diamine IUPAC Name: 4-N-(1-benzylpiperidin-4-yl)-6-chloro-2-N,4-N-dimethyl-5-phenylsulfanylpyrimidine-2,4-diamine Traditional Name: (1-benzyl-4-piperidyl)-[6-chloro-2-(methylamino)-5-(phenylthio)pyrimidin-4-yl]-methyl-amine Formula: C24H28ClN5S MolecularWeight: 454.03062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=C(C(=N1)Cl)SC2=CC=CC=C2)N(C)C3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CNC1=NC(=C(C(=N1)Cl)SC2=CC=CC=C2)N(C)C3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H28ClN5S/c1-26-24-27-22(25)21(31-20-11-7-4-8-12-20)23(28-24)29(2)19-13-15-30(16-14-19)17-18-9-5-3-6-10-18/h3-12,19H,13-17H2,1-2H3,(H,26,27,28)