[1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2,3-diphenyl-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: [1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2,3-diphenyl-3,4-dihydropyrazole-5-carboxylate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-1-methyl-2-oxo-ethyl] 2,3-diphenyl-3,4-dihydropyrazole-5-carboxylate CAS Name: 2,3-diphenyl-3,4-dihydropyrazole-5-carboxylic acid [1-[(3-cyano-2-thiophenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(3-cyanothiophen-2-yl)amino]-1-oxopropan-2-yl] 2,3-diphenyl-3,4-dihydropyrazole-5-carboxylate Traditional Name: 1,5-diphenyl-2-pyrazoline-3-carboxylic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C#N)OC(=O)C2=NN(C(C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C#N)OC(=O)C2=NN(C(C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H20N4O3S/c1-16(22(29)26-23-18(15-25)12-13-32-23)31-24(30)20-14-21(17-8-4-2-5-9-17)28(27-20)19-10-6-3-7-11-19/h2-13,16,21H,14H2,1H3,(H,26,29)