N-butyl-N-[2-[[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-butyl-N-[2-[[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-butyl-N-[2-[[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-butyl-N-[2-[[5-methyl-2-(2-methylphenyl)-4-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-butyl-N-[2-[[5-methyl-2-(2-methylphenyl)-4-phenylpyrazol-3-yl]amino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-butyl-N-[2-keto-2-[[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]amino]ethyl]thiophene-2-carboxamide Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=CC=C2C)C)C3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=CC=C2C)C)C3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C28H30N4O2S/c1-4-5-17-31(28(34)24-16-11-18-35-24)19-25(33)29-27-26(22-13-7-6-8-14-22)21(3)30-32(27)23-15-10-9-12-20(23)2/h6-16,18H,4-5,17,19H2,1-3H3,(H,29,33)