O2-ethyl O4-propyl 5-[[1-[(4-tert-butylphenoxy)methyl]pyrazol-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-propyl 5-[[1-[(4-tert-butylphenoxy)methyl]pyrazol-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-propyl 5-[[1-[(4-tert-butylphenoxy)methyl]pyrazole-3-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[1-[(4-tert-butylphenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propyl ester IUPAC Name: 2-O-ethyl 4-O-propyl 5-[[1-[(4-tert-butylphenoxy)methyl]pyrazole-3-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[1-[(4-tert-butylphenoxy)methyl]pyrazole-3-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propyl ester Formula: C27H33N3O6S MolecularWeight: 527.63242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H33N3O6S/c1-7-15-35-25(32)21-17(3)22(26(33)34-8-2)37-24(21)28-23(31)20-13-14-30(29-20)16-36-19-11-9-18(10-12-19)27(4,5)6/h9-14H,7-8,15-16H2,1-6H3,(H,28,31)