diethyl 5-[methylsulfonyl-(1,3,5-trimethylpyrazol-4-yl)carbamoyl]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[methylsulfonyl-(1,3,5-trimethylpyrazol-4-yl)carbamoyl]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[methylsulfonyl-(1,3,5-trimethylpyrazol-4-yl)carbamoyl]benzene-1,3-dicarboxylate CAS Name: 5-[[methylsulfonyl-(1,3,5-trimethyl-4-pyrazolyl)amino]-oxomethyl]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[methylsulfonyl-(1,3,5-trimethylpyrazol-4-yl)carbamoyl]benzene-1,3-dicarboxylate Traditional Name: 5-[mesyl-(1,3,5-trimethylpyrazol-4-yl)carbamoyl]benzene-1,3-dicarboxylic acid diethyl ester Formula: C20H25N3O7S MolecularWeight: 451.4934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(C2=C(N(N=C2C)C)C)S(=O)(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(C2=C(N(N=C2C)C)C)S(=O)(=O)C)C(=O)OCC

InChI

InChI=1S/C20H25N3O7S/c1-7-29-19(25)15-9-14(10-16(11-15)20(26)30-8-2)18(24)23(31(6,27)28)17-12(3)21-22(5)13(17)4/h9-11H,7-8H2,1-6H3