1-(4-methoxyphenyl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]piperidine-4-carboxamide Openeye Name: 1-(4-methoxyphenyl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]piperidine-4-carboxamide CAS Name: 1-(4-methoxyphenyl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]piperidine-4-carboxamide Traditional Name: 1-(4-methoxyphenyl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]isonipecotamide Formula: C20H22N6O4S MolecularWeight: 442.49148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CN=C(C=C3)N4C=NC=N4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CN=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C20H22N6O4S/c1-30-17-3-5-18(6-4-17)31(28,29)25-10-8-15(9-11-25)20(27)24-16-2-7-19(22-12-16)26-14-21-13-23-26/h2-7,12-15H,8-11H2,1H3,(H,24,27)