2-(4-methyl-6-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-(4-methyl-6-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-(4-methyl-6-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-N-phenethyl-acetamide CAS Name: 2-[(4-methyl-6-oxo-1-phenyl-2-pyrimidinyl)thio]-N-phenethylacetamide IUPAC Name: 2-(4-methyl-6-oxo-1-phenylpyrimidin-2-yl)sulfanyl-N-phenethylacetamide Traditional Name: 2-[(6-keto-4-methyl-1-phenyl-pyrimidin-2-yl)thio]-N-phenethyl-acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC(=O)NCCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC(=O)NCCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-16-14-20(26)24(18-10-6-3-7-11-18)21(23-16)27-15-19(25)22-13-12-17-8-4-2-5-9-17/h2-11,14H,12-13,15H2,1H3,(H,22,25)