3-(4-piperidin-1-ylsulfonylphenyl)-N-(1H-1,2,4-triazol-5-yl)propanamide

Systemtic Name: 3-(4-piperidin-1-ylsulfonylphenyl)-N-(1H-1,2,4-triazol-5-yl)propanamide Openeye Name: 3-[4-(1-piperidylsulfonyl)phenyl]-N-(1H-1,2,4-triazol-5-yl)propanamide CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]-N-(1H-1,2,4-triazol-5-yl)propanamide IUPAC Name: 3-(4-piperidin-1-ylsulfonylphenyl)-N-(1H-1,2,4-triazol-5-yl)propanamide Traditional Name: 3-(4-piperidinosulfonylphenyl)-N-(1H-1,2,4-triazol-5-yl)propionamide Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=NC=NN3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=NC=NN3

InChI

InChI=1S/C16H21N5O3S/c22-15(19-16-17-12-18-20-16)9-6-13-4-7-14(8-5-13)25(23,24)21-10-2-1-3-11-21/h4-5,7-8,12H,1-3,6,9-11H2,(H2,17,18,19,20,22)