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

Systemtic Name: methyl 5-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbamoyl]thiophene-2-carboxylate Openeye Name: methyl 5-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbamoyl]thiophene-2-carboxylate CAS Name: 5-[[(3,5-dimethyl-1-phenyl-4-pyrazolyl)amino]-oxomethyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(3,5-dimethyl-1-phenylpyrazol-4-yl)carbamoyl]thiophene-2-carboxylate Traditional Name: 5-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbamoyl]thiophene-2-carboxylic acid methyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C3=CC=C(S3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C3=CC=C(S3)C(=O)OC

InChI

InChI=1S/C18H17N3O3S/c1-11-16(12(2)21(20-11)13-7-5-4-6-8-13)19-17(22)14-9-10-15(25-14)18(23)24-3/h4-10H,1-3H3,(H,19,22)