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

Systemtic Name: propyl 2-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: propyl 2-[[5-(2-thienyl)-1H-pyrazole-3-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[oxo-(5-thiophen-2-yl-1H-pyrazol-3-yl)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propyl ester IUPAC Name: propyl 2-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[5-(2-thienyl)-1H-pyrazole-3-carbonyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid propyl ester Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NNC(=C3)C4=CC=CS4

Isomeric SMILES

CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NNC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H21N3O3S2/c1-2-9-26-20(25)17-12-6-3-4-7-15(12)28-19(17)21-18(24)14-11-13(22-23-14)16-8-5-10-27-16/h5,8,10-11H,2-4,6-7,9H2,1H3,(H,21,24)(H,22,23)