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

Systemtic Name: ethyl 4-[4-[(2-methoxycarbonyl-5-phenyl-thiophen-3-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(2-methoxycarbonyl-5-phenyl-3-thienyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[4-[[(2-methoxycarbonyl-5-phenyl-3-thiophenyl)amino]-oxomethyl]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2-methoxycarbonyl-5-phenylthiophen-3-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[4-[(2-carbomethoxy-5-phenyl-3-thienyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C26H27N3O7S2 MolecularWeight: 557.63848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C26H27N3O7S2/c1-3-36-26(32)28-13-15-29(16-14-28)38(33,34)20-11-9-19(10-12-20)24(30)27-21-17-22(18-7-5-4-6-8-18)37-23(21)25(31)35-2/h4-12,17H,3,13-16H2,1-2H3,(H,27,30)