N-[[4-(phenylmethyl)sulfonylphenyl]methyl]pyrimidin-2-amine

Systemtic Name: N-[[4-(phenylmethyl)sulfonylphenyl]methyl]pyrimidin-2-amine Openeye Name: N-[(4-benzylsulfonylphenyl)methyl]pyrimidin-2-amine CAS Name: N-[[4-(phenylmethyl)sulfonylphenyl]methyl]-2-pyrimidinamine IUPAC Name: N-[(4-benzylsulfonylphenyl)methyl]pyrimidin-2-amine Traditional Name: (4-benzylsulfonylbenzyl)-(2-pyrimidyl)amine Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=CC=C(C=C2)CNC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=CC=C(C=C2)CNC3=NC=CC=N3

InChI

InChI=1S/C18H17N3O2S/c22-24(23,14-16-5-2-1-3-6-16)17-9-7-15(8-10-17)13-21-18-19-11-4-12-20-18/h1-12H,13-14H2,(H,19,20,21)