(2S)-2-[[5-cyano-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-naphthalen-1-yl-butanamide

Systemtic Name: (2S)-2-[[5-cyano-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-naphthalen-1-yl-butanamide Openeye Name: (2S)-2-[[5-cyano-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(1-naphthyl)butanamide CAS Name: (2S)-2-[[5-cyano-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]thio]-N-(1-naphthalenyl)butanamide IUPAC Name: (2S)-2-[[5-cyano-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-naphthalen-1-ylbutanamide Traditional Name: (2S)-2-[[5-cyano-4-keto-6-(4-methoxyphenyl)-1H-pyrimidin-2-yl]thio]-N-(1-naphthyl)butyramide Formula: C26H22N4O3S MolecularWeight: 470.54288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC(=O)C(=C(N3)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC(=O)C(=C(N3)C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C26H22N4O3S/c1-3-22(25(32)28-21-10-6-8-16-7-4-5-9-19(16)21)34-26-29-23(20(15-27)24(31)30-26)17-11-13-18(33-2)14-12-17/h4-14,22H,3H2,1-2H3,(H,28,32)(H,29,30,31)/t22-/m0/s1