propyl 2-[(5-methyl-1,3-diphenyl-pyrazol-4-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: propyl 2-[(5-methyl-1,3-diphenyl-pyrazol-4-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: propyl 2-[(5-methyl-1,3-diphenyl-pyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[(5-methyl-1,3-diphenyl-4-pyrazolyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propyl ester IUPAC Name: propyl 2-[(5-methyl-1,3-diphenylpyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(5-methyl-1,3-diphenyl-pyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid propyl ester Formula: C29H29N3O3S MolecularWeight: 499.62386

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C29H29N3O3S/c1-3-18-35-29(34)25-22-16-10-11-17-23(22)36-28(25)30-27(33)24-19(2)32(21-14-8-5-9-15-21)31-26(24)20-12-6-4-7-13-20/h4-9,12-15H,3,10-11,16-18H2,1-2H3,(H,30,33)