[2-[5-(2-acetamidoethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 2-phenyl-4,5,6,7-tetrahydroindazole-3-carboxylate

Systemtic Name: [2-[5-(2-acetamidoethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 2-phenyl-4,5,6,7-tetrahydroindazole-3-carboxylate Openeye Name: [2-[5-(2-acetamidoethyl)-2-thienyl]-2-oxo-ethyl] 2-phenyl-4,5,6,7-tetrahydroindazole-3-carboxylate CAS Name: 2-phenyl-4,5,6,7-tetrahydroindazole-3-carboxylic acid [2-[5-(2-acetamidoethyl)-2-thiophenyl]-2-oxoethyl] ester IUPAC Name: [2-[5-(2-acetamidoethyl)thiophen-2-yl]-2-oxoethyl] 2-phenyl-4,5,6,7-tetrahydroindazole-3-carboxylate Traditional Name: 2-phenyl-4,5,6,7-tetrahydroindazole-3-carboxylic acid [2-[5-(2-acetamidoethyl)-2-thienyl]-2-keto-ethyl] ester Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC=C(S1)C(=O)COC(=O)C2=C3CCCCC3=NN2C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCC1=CC=C(S1)C(=O)COC(=O)C2=C3CCCCC3=NN2C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O4S/c1-16(28)25-14-13-18-11-12-22(32-18)21(29)15-31-24(30)23-19-9-5-6-10-20(19)26-27(23)17-7-3-2-4-8-17/h2-4,7-8,11-12H,5-6,9-10,13-15H2,1H3,(H,25,28)