ethyl 4-[4-[(3-ethoxycarbonyl-4-methyl-5-propanoyloxy-thiophen-2-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(3-ethoxycarbonyl-4-methyl-5-propanoyloxy-thiophen-2-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(3-ethoxycarbonyl-4-methyl-5-propanoyloxy-2-thienyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[4-[[[3-ethoxycarbonyl-4-methyl-5-(1-oxopropoxy)-2-thiophenyl]amino]-oxomethyl]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-ethoxycarbonyl-4-methyl-5-propanoyloxythiophen-2-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[4-[(3-carbethoxy-4-methyl-5-propionyloxy-2-thienyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C25H31N3O9S2 MolecularWeight: 581.65834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)OCC)C(=O)OCC)C

Isomeric SMILES

CCC(=O)OC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)OCC)C(=O)OCC)C

InChI

InChI=1S/C25H31N3O9S2/c1-5-19(29)37-24-16(4)20(23(31)35-6-2)22(38-24)26-21(30)17-8-10-18(11-9-17)39(33,34)28-14-12-27(13-15-28)25(32)36-7-3/h8-11H,5-7,12-15H2,1-4H3,(H,26,30)