N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[[(4-ethylphenyl)-thiophen-2-yl-methyl]amino]ethanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[[(4-ethylphenyl)-thiophen-2-yl-methyl]amino]ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[[(4-ethylphenyl)-(2-thienyl)methyl]amino]acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[[(4-ethylphenyl)-thiophen-2-ylmethyl]amino]acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[[(4-ethylphenyl)-thiophen-2-ylmethyl]amino]acetamide Traditional Name: 2-[[(4-ethylphenyl)-(2-thienyl)methyl]amino]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C26H28N4O2S/c1-4-19-12-14-20(15-13-19)25(22-11-8-16-33-22)27-17-23(31)28-24-18(2)29(3)30(26(24)32)21-9-6-5-7-10-21/h5-16,25,27H,4,17H2,1-3H3,(H,28,31)