1-(5-methylthiophen-2-yl)sulfonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrrolidine-2-carboxamide Openeye Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrrolidine-2-carboxamide CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrrolidine-2-carboxamide Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]pyrrolidine-2-carboxamide Formula: C20H23N5O3S2 MolecularWeight: 445.55832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H23N5O3S2/c1-15-4-9-19(29-15)30(27,28)25-10-2-3-18(25)20(26)22-11-16-5-7-17(8-6-16)12-24-14-21-13-23-24/h4-9,13-14,18H,2-3,10-12H2,1H3,(H,22,26)