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

Systemtic Name: dimethyl 5-[[1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazol-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[[1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazole-3-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[1-[(4-chloro-3-methylphenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-[(4-chloro-3-methylphenoxy)methyl]pyrazole-3-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazole-3-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C21H20ClN3O6S MolecularWeight: 477.918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=C(C(=C(S3)C(=O)OC)C)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=C(C(=C(S3)C(=O)OC)C)C(=O)OC)Cl

InChI

InChI=1S/C21H20ClN3O6S/c1-11-9-13(5-6-14(11)22)31-10-25-8-7-15(24-25)18(26)23-19-16(20(27)29-3)12(2)17(32-19)21(28)30-4/h5-9H,10H2,1-4H3,(H,23,26)