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

Systemtic Name: O2-ethyl O4-propyl 3-methyl-5-[[1-[(4-phenylphenoxy)methyl]pyrazol-3-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-propyl 3-methyl-5-[[1-[(4-phenylphenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[1-[(4-phenylphenoxy)methyl]-3-pyrazolyl]methyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propyl ester IUPAC Name: 2-O-ethyl 4-O-propyl 3-methyl-5-[[1-[(4-phenylphenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[1-[(4-phenylphenoxy)methyl]pyrazole-3-carbonyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propyl ester Formula: C29H29N3O6S MolecularWeight: 547.62206

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)C4=CC=CC=C4

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O6S/c1-4-17-37-28(34)24-19(3)25(29(35)36-5-2)39-27(24)30-26(33)23-15-16-32(31-23)18-38-22-13-11-21(12-14-22)20-9-7-6-8-10-20/h6-16H,4-5,17-18H2,1-3H3,(H,30,33)