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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(4-chlorophenyl)ethyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(4-chlorophenyl)ethyl]acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[2-(4-chlorophenyl)ethyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(4-chlorophenyl)ethyl]acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-[2-(4-chlorophenyl)ethyl]acetamide Formula: C14H15ClN4O2S MolecularWeight: 338.8125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)CSC2=NC(=O)C=C(N2)N)Cl

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)CSC2=NC(=O)C=C(N2)N)Cl

InChI

InChI=1S/C14H15ClN4O2S/c15-10-3-1-9(2-4-10)5-6-17-13(21)8-22-14-18-11(16)7-12(20)19-14/h1-4,7H,5-6,8H2,(H,17,21)(H3,16,18,19,20)