N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-piperidinosulfonylphenyl)acetamide Formula: C21H22ClN5O3S MolecularWeight: 459.94908

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4

InChI

InChI=1S/C21H22ClN5O3S/c22-17-6-9-20(27-15-23-14-24-27)19(13-17)25-21(28)12-16-4-7-18(8-5-16)31(29,30)26-10-2-1-3-11-26/h4-9,13-15H,1-3,10-12H2,(H,25,28)