1-(4-fluorophenyl)-5-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-5-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]-1,2,4-triazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-5-methyl-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]-1,2,4-triazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-5-methyl-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-1,2,4-triazole-3-carboxamide IUPAC Name: 1-(4-fluorophenyl)-5-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]-1,2,4-triazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-5-methyl-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]-1,2,4-triazole-3-carboxamide Formula: C19H20FN5O3S2 MolecularWeight: 449.522203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C19H20FN5O3S2/c1-13-22-18(23-25(13)15-6-4-14(20)5-7-15)19(26)21-12-16-8-9-17(29-16)30(27,28)24-10-2-3-11-24/h4-9H,2-3,10-12H2,1H3,(H,21,26)