1-(4-methoxyphenyl)sulfonyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(4-methoxyphenyl)sulfonyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(4-methoxyphenyl)sulfonyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(4-methoxyphenyl)sulfonyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]isonipecotamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C22H25N5O4S/c1-31-20-6-8-21(9-7-20)32(29,30)27-12-10-18(11-13-27)22(28)25-19-4-2-17(3-5-19)14-26-16-23-15-24-26/h2-9,15-16,18H,10-14H2,1H3,(H,25,28)