N-methyl-2-methylsulfanyl-4-[(phenylmethyl)amino]-6-(phenylmethylsulfanyl)pyrimidine-5-carboxamide

Systemtic Name: N-methyl-2-methylsulfanyl-4-[(phenylmethyl)amino]-6-(phenylmethylsulfanyl)pyrimidine-5-carboxamide Openeye Name: 4-(benzylamino)-6-benzylsulfanyl-N-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-methyl-2-(methylthio)-4-[(phenylmethyl)amino]-6-(phenylmethylthio)-5-pyrimidinecarboxamide IUPAC Name: 4-(benzylamino)-6-benzylsulfanyl-N-methyl-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: 4-(benzylamino)-6-(benzylthio)-N-methyl-2-(methylthio)pyrimidine-5-carboxamide Formula: C21H22N4OS2 MolecularWeight: 410.55558

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(N=C(N=C1SCC2=CC=CC=C2)SC)NCC3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=C(N=C(N=C1SCC2=CC=CC=C2)SC)NCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4OS2/c1-22-19(26)17-18(23-13-15-9-5-3-6-10-15)24-21(27-2)25-20(17)28-14-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3,(H,22,26)(H,23,24,25)