N-methyl-N-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-methyl-N-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(2-keto-2-mesidino-ethyl)-N-methyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CN(C)C(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CN(C)C(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)C

InChI

InChI=1S/C27H28N4O2S/c1-18-13-19(2)25(20(3)14-18)28-24(32)17-30(4)27(33)22-16-31(15-21-9-6-5-7-10-21)29-26(22)23-11-8-12-34-23/h5-14,16H,15,17H2,1-4H3,(H,28,32)