ethyl 4-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]pyridin-2-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]pyridin-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]pyridine-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(4-methoxyphenyl)sulfonyl-methylamino]-2-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(4-methoxyphenyl)sulfonyl-methylamino]pyridine-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]picolinoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H26N4O6S MolecularWeight: 462.51934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=NC=CC(=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=NC=CC(=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N4O6S/c1-4-31-21(27)25-13-11-24(12-14-25)20(26)19-15-16(9-10-22-19)23(2)32(28,29)18-7-5-17(30-3)6-8-18/h5-10,15H,4,11-14H2,1-3H3