N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]-2-methylsulfanyl-benzamide

Systemtic Name: N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]-2-methylsulfanyl-benzamide Openeye Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-methylsulfanyl-benzamide CAS Name: N-[2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-3-pyrazolyl]-2-(methylthio)benzamide IUPAC Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-2-methylsulfanylbenzamide Traditional Name: N-[2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-(methylthio)benzamide Formula: C27H23N5O2S2 MolecularWeight: 513.63382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=CC=CC=C4SC)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=CC=CC=C4SC)CC5=CC=CC=C5

InChI

InChI=1S/C27H23N5O2S2/c1-17-20(15-18-9-4-3-5-10-18)26(34)30-27(28-17)32-24(16-21(31-32)23-13-8-14-36-23)29-25(33)19-11-6-7-12-22(19)35-2/h3-14,16H,15H2,1-2H3,(H,29,33)(H,28,30,34)