4-chloranyl-3-piperidin-1-ylsulfonyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide

Systemtic Name: 4-chloranyl-3-piperidin-1-ylsulfonyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide Openeye Name: 4-chloro-3-(1-piperidylsulfonyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide IUPAC Name: 4-chloro-3-piperidin-1-ylsulfonyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide Traditional Name: 4-chloro-3-piperidinosulfonyl-N-[4-(1,2,4-triazol-1-yl)phenyl]benzamide Formula: C20H20ClN5O3S MolecularWeight: 445.9225

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClN5O3S/c21-18-9-4-15(12-19(18)30(28,29)25-10-2-1-3-11-25)20(27)24-16-5-7-17(8-6-16)26-14-22-13-23-26/h4-9,12-14H,1-3,10-11H2,(H,24,27)