N2-[(1-phenethylsulfonylpiperidin-4-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: N2-[(1-phenethylsulfonylpiperidin-4-yl)methyl]pyrimidine-2,4-diamine Openeye Name: N2-[(1-phenethylsulfonyl-4-piperidyl)methyl]pyrimidine-2,4-diamine CAS Name: N2-[(1-phenethylsulfonyl-4-piperidinyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-[(1-phenethylsulfonylpiperidin-4-yl)methyl]pyrimidine-2,4-diamine Traditional Name: (4-aminopyrimidin-2-yl)-[(1-phenethylsulfonyl-4-piperidyl)methyl]amine Formula: C18H25N5O2S MolecularWeight: 375.4884

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=NC=CC(=N2)N)S(=O)(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CNC2=NC=CC(=N2)N)S(=O)(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C18H25N5O2S/c19-17-6-10-20-18(22-17)21-14-16-7-11-23(12-8-16)26(24,25)13-9-15-4-2-1-3-5-15/h1-6,10,16H,7-9,11-14H2,(H3,19,20,21,22)