N-[[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamoyl]phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamoyl]phenyl]methyl]thiophene-2-carboxamide Openeye Name: N-[[4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)carbamoyl]phenyl]methyl]thiophene-2-carboxamide CAS Name: N-[[4-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-oxomethyl]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-[4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)carbamoyl]benzyl]thiophene-2-carboxamide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C24H22N4O3S/c1-16-21(24(31)28(27(16)2)19-7-4-3-5-8-19)26-22(29)18-12-10-17(11-13-18)15-25-23(30)20-9-6-14-32-20/h3-14H,15H2,1-2H3,(H,25,30)(H,26,29)