methyl 4-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl]carbonylamino]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl]carbonylamino]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[[1-(3,5-dimethylisoxazol-4-yl)sulfonylpiperidine-4-carbonyl]amino]-1H-pyrrole-2-carboxylate CAS Name: 4-[[[1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-4-piperidinyl]-oxomethyl]amino]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carbonyl]amino]-1H-pyrrole-2-carboxylate Traditional Name: 4-[[1-(3,5-dimethylisoxazol-4-yl)sulfonylisonipecotoyl]amino]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C17H22N4O6S MolecularWeight: 410.44478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CNC(=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CNC(=C3)C(=O)OC

InChI

InChI=1S/C17H22N4O6S/c1-10-15(11(2)27-20-10)28(24,25)21-6-4-12(5-7-21)16(22)19-13-8-14(18-9-13)17(23)26-3/h8-9,12,18H,4-7H2,1-3H3,(H,19,22)