N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C19H21N5O3S2 MolecularWeight: 431.53174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H21N5O3S2/c1-23-13-20-22-18(23)15-4-2-5-16(12-15)21-19(25)14-7-9-24(10-8-14)29(26,27)17-6-3-11-28-17/h2-6,11-14H,7-10H2,1H3,(H,21,25)