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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(phenylmethyl)carbamoyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(benzylcarbamoyl)acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[oxo-[(phenylmethyl)amino]methyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(benzylcarbamoyl)acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(benzylcarbamoyl)acetamide Formula: C14H15N5O3S MolecularWeight: 333.3656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC(=O)CSC2=NC(=O)C=C(N2)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC(=O)CSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C14H15N5O3S/c15-10-6-11(20)19-14(17-10)23-8-12(21)18-13(22)16-7-9-4-2-1-3-5-9/h1-6H,7-8H2,(H3,15,17,19,20)(H2,16,18,21,22)