2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N,N'-diphenyl-propanediamide

Systemtic Name: 2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N,N'-diphenyl-propanediamide Openeye Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N,N'-diphenyl-propanediamide CAS Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]-N,N'-diphenylpropanediamide IUPAC Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N,N'-diphenylpropanediamide Traditional Name: 2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]-N,N'-diphenyl-malonamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C(=O)NC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC(C(=O)NC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H22N4O3S/c1-2-9-17-14-18(27)26-22(25-17)30-19(20(28)23-15-10-5-3-6-11-15)21(29)24-16-12-7-4-8-13-16/h3-8,10-14,19H,2,9H2,1H3,(H,23,28)(H,24,29)(H,25,26,27)