2-[[(4S)-4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl]sulfanyl]-N,N'-diphenyl-propanediamide

Systemtic Name: 2-[[(4S)-4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl]sulfanyl]-N,N'-diphenyl-propanediamide Openeye Name: 2-[[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]sulfanyl]-N,N'-diphenyl-propanediamide CAS Name: 2-[[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]thio]-N,N'-diphenylpropanediamide IUPAC Name: 2-[[(4S)-4-methyl-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]sulfanyl]-N,N'-diphenylpropanediamide Traditional Name: 2-[[(4S)-6-keto-4-methyl-4,5-dihydro-1H-pyrimidin-2-yl]thio]-N,N'-diphenyl-malonamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC(=N1)SC(C(=O)NC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CC(=O)NC(=N1)SC(C(=O)NC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S/c1-13-12-16(25)24-20(21-13)28-17(18(26)22-14-8-4-2-5-9-14)19(27)23-15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3,(H,22,26)(H,23,27)(H,21,24,25)/t13-/m0/s1