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

Systemtic Name: 2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: N-(benzylcarbamoyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-[oxo-[(phenylmethyl)amino]methyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(benzylcarbamoyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(benzylcarbamoyl)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]propionamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O3S/c1-3-7-14-10-15(23)21-18(20-14)26-12(2)16(24)22-17(25)19-11-13-8-5-4-6-9-13/h4-6,8-10,12H,3,7,11H2,1-2H3,(H,20,21,23)(H2,19,22,24,25)