N-[4-azanyl-6-(phenylmethylsulfanyl)pyrimidin-5-yl]-N-(phenylmethyl)methanamide

Systemtic Name: N-[4-azanyl-6-(phenylmethylsulfanyl)pyrimidin-5-yl]-N-(phenylmethyl)methanamide Openeye Name: N-(4-amino-6-benzylsulfanyl-pyrimidin-5-yl)-N-benzyl-formamide CAS Name: N-[4-amino-6-(phenylmethylthio)-5-pyrimidinyl]-N-(phenylmethyl)formamide IUPAC Name: N-(4-amino-6-benzylsulfanylpyrimidin-5-yl)-N-benzylformamide Traditional Name: N-[4-amino-6-(benzylthio)pyrimidin-5-yl]-N-benzyl-formamide Formula: C19H18N4OS MolecularWeight: 350.43742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C=O)C2=C(N=CN=C2SCC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CN(C=O)C2=C(N=CN=C2SCC3=CC=CC=C3)N

InChI

InChI=1S/C19H18N4OS/c20-18-17(23(14-24)11-15-7-3-1-4-8-15)19(22-13-21-18)25-12-16-9-5-2-6-10-16/h1-10,13-14H,11-12H2,(H2,20,21,22)