N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4

InChI

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