N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H21N5O4S/c26-19-8-7-17(30(28,29)25-9-1-2-10-25)11-18(19)23-20(27)16-5-3-15(4-6-16)12-24-14-21-13-22-24/h3-8,11,13-14,26H,1-2,9-10,12H2,(H,23,27)