methyl 2-[(4-chloranyl-1,5-dimethyl-pyrazol-3-yl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-chloranyl-1,5-dimethyl-pyrazol-3-yl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(4-chloro-1,5-dimethyl-pyrazole-3-carbonyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(4-chloro-1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-1,5-dimethylpyrazole-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(4-chloro-1,5-dimethyl-pyrazole-3-carbonyl)amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)Cl

InChI

InChI=1S/C18H16ClN3O3S/c1-10-14(19)15(21-22(10)2)16(23)20-17-13(18(24)25-3)12(9-26-17)11-7-5-4-6-8-11/h4-9H,1-3H3,(H,20,23)