2-[4-(1-ethyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]sulfanyl-N-phenyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(1-ethyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]sulfanyl-N-phenyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(1-ethyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[4-(1-ethyl-3-methyl-4-pyrazolyl)-2-pyrimidinyl]thio]-N-phenyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(1-ethyl-3-methylpyrazol-4-yl)pyrimidin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: N-benzyl-2-[[4-(1-ethyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]thio]-N-phenyl-acetamide Formula: C25H25N5OS MolecularWeight: 443.5639

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C2=NC(=NC=C2)SCC(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C=C(C(=N1)C)C2=NC(=NC=C2)SCC(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25N5OS/c1-3-29-17-22(19(2)28-29)23-14-15-26-25(27-23)32-18-24(31)30(21-12-8-5-9-13-21)16-20-10-6-4-7-11-20/h4-15,17H,3,16,18H2,1-2H3