methyl 3-[4-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonylpiperazin-1-yl]sulfonylthiophene-2-carboxylate

Systemtic Name: methyl 3-[4-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonylpiperazin-1-yl]sulfonylthiophene-2-carboxylate Openeye Name: methyl 3-[4-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonylpiperazin-1-yl]sulfonylthiophene-2-carboxylate CAS Name: 3-[[4-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-1-piperazinyl]sulfonyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylpiperazin-1-yl]sulfonylthiophene-2-carboxylate Traditional Name: 3-[4-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonylpiperazino]sulfonylthiophene-2-carboxylic acid methyl ester Formula: C16H20N4O7S3 MolecularWeight: 476.5476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=C(SC=C3)C(=O)OC

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C16H20N4O7S3/c1-18-10-11(9-12(18)15(17)21)29(23,24)19-4-6-20(7-5-19)30(25,26)13-3-8-28-14(13)16(22)27-2/h3,8-10H,4-7H2,1-2H3,(H2,17,21)