(2S)-2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-phenyl-N-(phenylmethyl)ethanamide

Systemtic Name: (2S)-2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-phenyl-N-(phenylmethyl)ethanamide Openeye Name: (2S)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-benzyl-2-phenyl-acetamide CAS Name: (2S)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-2-phenyl-N-(phenylmethyl)acetamide IUPAC Name: (2S)-2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-benzyl-2-phenylacetamide Traditional Name: (2S)-2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-benzyl-2-phenyl-acetamide Formula: C19H18N4O2S MolecularWeight: 366.43682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(C2=CC=CC=C2)SC3=NC(=O)C=C(N3)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)[C@H](C2=CC=CC=C2)SC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C19H18N4O2S/c20-15-11-16(24)23-19(22-15)26-17(14-9-5-2-6-10-14)18(25)21-12-13-7-3-1-4-8-13/h1-11,17H,12H2,(H,21,25)(H3,20,22,23,24)/t17-/m0/s1