N-[5-cyclopropyl-2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[5-cyclopropyl-2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[5-cyclopropyl-2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]acetamide CAS Name: N-[5-cyclopropyl-2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-3-pyrazolyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[5-cyclopropyl-2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]acetamide Traditional Name: 2-(benzylthio)-N-[5-cyclopropyl-2-(4-keto-6-phenyl-1H-pyrimidin-2-yl)pyrazol-3-yl]acetamide Formula: C25H23N5O2S MolecularWeight: 457.54742

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)NC(=O)CSCC3=CC=CC=C3)C4=NC(=O)C=C(N4)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN(C(=C2)NC(=O)CSCC3=CC=CC=C3)C4=NC(=O)C=C(N4)C5=CC=CC=C5

InChI

InChI=1S/C25H23N5O2S/c31-23-14-20(18-9-5-2-6-10-18)26-25(28-23)30-22(13-21(29-30)19-11-12-19)27-24(32)16-33-15-17-7-3-1-4-8-17/h1-10,13-14,19H,11-12,15-16H2,(H,27,32)(H,26,28,31)