2-phenyl-N4-(phenylmethyl)-6-(phenylmethylsulfanyl)pyrimidine-4,5-diamine

Systemtic Name: 2-phenyl-N4-(phenylmethyl)-6-(phenylmethylsulfanyl)pyrimidine-4,5-diamine Openeye Name: N4-benzyl-6-benzylsulfanyl-2-phenyl-pyrimidine-4,5-diamine CAS Name: 2-phenyl-N4-(phenylmethyl)-6-(phenylmethylthio)pyrimidine-4,5-diamine IUPAC Name: 4-N-benzyl-6-benzylsulfanyl-2-phenylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(benzylthio)-2-phenyl-pyrimidin-4-yl]-benzyl-amine Formula: C24H22N4S MolecularWeight: 398.52328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NC(=N2)C3=CC=CC=C3)SCC4=CC=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NC(=N2)C3=CC=CC=C3)SCC4=CC=CC=C4)N

InChI

InChI=1S/C24H22N4S/c25-21-23(26-16-18-10-4-1-5-11-18)27-22(20-14-8-3-9-15-20)28-24(21)29-17-19-12-6-2-7-13-19/h1-15H,16-17,25H2,(H,26,27,28)