2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(3-chlorophenyl)methyl]ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(3-chlorophenyl)methyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(3-chlorophenyl)methyl]acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[(3-chlorophenyl)methyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(3-chlorophenyl)methyl]acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(3-chlorobenzyl)acetamide Formula: C13H13ClN4O2S MolecularWeight: 324.78592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN4O2S/c14-9-3-1-2-8(4-9)6-16-12(20)7-21-13-17-10(15)5-11(19)18-13/h1-5H,6-7H2,(H,16,20)(H3,15,17,18,19)