methyl 5-ethanoyl-4-methyl-2-[[(5E)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-3-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-ethanoyl-4-methyl-2-[[(5E)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-3-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-acetyl-4-methyl-2-[[(5E)-5-(5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[[(5E)-5-(5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazol-3-yl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-4-methyl-2-[[(5E)-5-(5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[(5E)-5-(6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C2C=C(NN2)C(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OC)C1=O

Isomeric SMILES

CC1=CC=C/C(=C\2/C=C(NN2)C(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OC)/C1=O

InChI

InChI=1S/C20H19N3O5S/c1-9-6-5-7-12(16(9)25)13-8-14(23-22-13)18(26)21-19-15(20(27)28-4)10(2)17(29-19)11(3)24/h5-8,22-23H,1-4H3,(H,21,26)/b13-12+