2-[[5,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[5,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(5,6-diamino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(5,6-diamino-4-keto-1H-pyrimidin-2-yl)thio]-N-phenethyl-acetamide Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5O2S/c15-11-12(16)18-14(19-13(11)21)22-8-10(20)17-7-6-9-4-2-1-3-5-9/h1-5H,6-8,15H2,(H,17,20)(H3,16,18,19,21)