N-(4-chlorophenyl)-4-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(4-chlorophenyl)-4-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(4-chlorophenyl)-4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(4-chlorophenyl)-4-[[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]methyl]benzamide IUPAC Name: N-(4-chlorophenyl)-4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(4-chlorophenyl)-4-[[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]methyl]benzamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClN3O2S/c1-2-3-18-12-19(26)25-21(24-18)28-13-14-4-6-15(7-5-14)20(27)23-17-10-8-16(22)9-11-17/h4-12H,2-3,13H2,1H3,(H,23,27)(H,24,25,26)