methyl 2-[4-[[(1-methylindol-3-yl)carbonylamino]carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[[(1-methylindol-3-yl)carbonylamino]carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[[(1-methylindole-3-carbonyl)amino]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[[(1-methyl-3-indolyl)-oxomethyl]hydrazo]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[(1-methylindole-3-carbonyl)amino]carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[[(1-methylindole-3-carbonyl)amino]carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C24H26N4O6S MolecularWeight: 498.55144

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)NNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)NNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C24H26N4O6S/c1-27-15-19(17-7-3-5-9-20(17)27)23(30)26-25-22(29)16-11-13-28(14-12-16)35(32,33)21-10-6-4-8-18(21)24(31)34-2/h3-10,15-16H,11-14H2,1-2H3,(H,25,29)(H,26,30)