methyl 3-methyl-4-[[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate

Systemtic Name: methyl 3-methyl-4-[[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: methyl 3-methyl-4-[[2-[2-methyl-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]amino]benzoate CAS Name: 3-methyl-4-[[2-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-methyl-4-[[2-(2-methyl-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]amino]benzoate Traditional Name: 4-[[2-keto-2-(2-methyl-5-piperidinosulfonyl-anilino)ethyl]amino]-3-methyl-benzoic acid methyl ester Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CNC3=C(C=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CNC3=C(C=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C23H29N3O5S/c1-16-7-9-19(32(29,30)26-11-5-4-6-12-26)14-21(16)25-22(27)15-24-20-10-8-18(13-17(20)2)23(28)31-3/h7-10,13-14,24H,4-6,11-12,15H2,1-3H3,(H,25,27)