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

Systemtic Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidinosulfonyl-benzamide Formula: C19H18FN5O3S MolecularWeight: 415.441323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NNC(=N3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NNC(=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H18FN5O3S/c20-15-7-3-13(4-8-15)17-21-19(24-23-17)22-18(26)14-5-9-16(10-6-14)29(27,28)25-11-1-2-12-25/h3-10H,1-2,11-12H2,(H2,21,22,23,24,26)