N-(3-chlorophenyl)-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)sulfonyl]propanamide

Systemtic Name: N-(3-chlorophenyl)-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)sulfonyl]propanamide Openeye Name: N-(3-chlorophenyl)-3-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]sulfonyl]propanamide CAS Name: N-(3-chlorophenyl)-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)sulfonyl]propanamide IUPAC Name: N-(3-chlorophenyl)-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)sulfonyl]propanamide Traditional Name: N-(3-chlorophenyl)-3-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]sulfonyl]propionamide Formula: C16H14ClN5O3S MolecularWeight: 391.83206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=O)CCS(=O)(=O)C2=NC(=NN2)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=O)CCS(=O)(=O)C2=NC(=NN2)C3=CC=NC=C3

InChI

InChI=1S/C16H14ClN5O3S/c17-12-2-1-3-13(10-12)19-14(23)6-9-26(24,25)16-20-15(21-22-16)11-4-7-18-8-5-11/h1-5,7-8,10H,6,9H2,(H,19,23)(H,20,21,22)