4-[[2-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]amino]-N-methyl-benzamide

Systemtic Name: 4-[[2-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]amino]-N-methyl-benzamide Openeye Name: 4-[[2-[3-(3,4-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]amino]-N-methyl-benzamide CAS Name: 4-[[2-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 4-[[2-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]amino]-N-methylbenzamide Traditional Name: 4-[[2-[5-(3,4-dimethoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethyl]amino]-N-methyl-benzamide Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H26N4O4S/c1-26-25(31)16-6-9-18(10-7-16)27-15-24(30)29-20(14-19(28-29)23-5-4-12-34-23)17-8-11-21(32-2)22(13-17)33-3/h4-13,20,27H,14-15H2,1-3H3,(H,26,31)