6-azanyl-5-[(phenylmethyl)amino]-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-5-[(phenylmethyl)amino]-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-amino-5-(benzylamino)-2-benzylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-5-[(phenylmethyl)amino]-2-(phenylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-amino-5-(benzylamino)-2-benzylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-5-(benzylamino)-2-(benzylthio)-1H-pyrimidin-4-one Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(NC(=NC2=O)SCC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(NC(=NC2=O)SCC3=CC=CC=C3)N

InChI

InChI=1S/C18H18N4OS/c19-16-15(20-11-13-7-3-1-4-8-13)17(23)22-18(21-16)24-12-14-9-5-2-6-10-14/h1-10,20H,11-12H2,(H3,19,21,22,23)