N-(3-chloranyl-4-methyl-phenyl)-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]propionamide Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC(=O)C=C(N2)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC(=O)C=C(N2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C20H18ClN3O2S/c1-12-8-9-15(10-16(12)21)22-19(26)13(2)27-20-23-17(11-18(25)24-20)14-6-4-3-5-7-14/h3-11,13H,1-2H3,(H,22,26)(H,23,24,25)