N-(4-carbamothioylphenyl)-3-(2-oxidanylidenepyrimidin-1-yl)propanamide

Systemtic Name: N-(4-carbamothioylphenyl)-3-(2-oxidanylidenepyrimidin-1-yl)propanamide Openeye Name: N-(4-carbamothioylphenyl)-3-(2-oxopyrimidin-1-yl)propanamide CAS Name: N-(4-carbamothioylphenyl)-3-(2-oxo-1-pyrimidinyl)propanamide IUPAC Name: N-(4-carbamothioylphenyl)-3-(2-oxopyrimidin-1-yl)propanamide Traditional Name: 3-(2-ketopyrimidin-1-yl)-N-(4-thiocarbamoylphenyl)propionamide Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1)CCC(=O)NC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1=CN(C(=O)N=C1)CCC(=O)NC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C14H14N4O2S/c15-13(21)10-2-4-11(5-3-10)17-12(19)6-9-18-8-1-7-16-14(18)20/h1-5,7-8H,6,9H2,(H2,15,21)(H,17,19)