2-chloranyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-5-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: 2-chloranyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-5-(1,2,4-triazol-4-yl)benzamide Openeye Name: 2-chloro-N-(3-pyrrolidin-1-ylsulfonylphenyl)-5-(1,2,4-triazol-4-yl)benzamide CAS Name: 2-chloro-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-5-(1,2,4-triazol-4-yl)benzamide IUPAC Name: 2-chloro-N-(3-pyrrolidin-1-ylsulfonylphenyl)-5-(1,2,4-triazol-4-yl)benzamide Traditional Name: 2-chloro-N-(3-pyrrolidinosulfonylphenyl)-5-(1,2,4-triazol-4-yl)benzamide Formula: C19H18ClN5O3S MolecularWeight: 431.89592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(C=CC(=C3)N4C=NN=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(C=CC(=C3)N4C=NN=C4)Cl

InChI

InChI=1S/C19H18ClN5O3S/c20-18-7-6-15(24-12-21-22-13-24)11-17(18)19(26)23-14-4-3-5-16(10-14)29(27,28)25-8-1-2-9-25/h3-7,10-13H,1-2,8-9H2,(H,23,26)