methyl 3-[[4-(1-methylindol-5-yl)sulfonylpiperazin-1-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(1-methylindol-5-yl)sulfonylpiperazin-1-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-(1-methylindol-5-yl)sulfonylpiperazine-1-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[4-[(1-methyl-5-indolyl)sulfonyl]-1-piperazinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(1-methylindol-5-yl)sulfonylpiperazine-1-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[4-(1-methylindol-5-yl)sulfonylpiperazine-1-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)NC4=C(SC=C4)C(=O)OC

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)NC4=C(SC=C4)C(=O)OC

InChI

InChI=1S/C20H22N4O5S2/c1-22-7-5-14-13-15(3-4-17(14)22)31(27,28)24-10-8-23(9-11-24)20(26)21-16-6-12-30-18(16)19(25)29-2/h3-7,12-13H,8-11H2,1-2H3,(H,21,26)