N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[3-methyl-4-(1-pyrrolidinyl)phenyl]-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3-methyl-4-pyrrolidin-1-ylphenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(3-methyl-4-pyrrolidino-phenyl)-2-[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H23N5OS2 MolecularWeight: 413.55952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=NNC(=N2)CC3=CC=CS3)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=NNC(=N2)CC3=CC=CS3)N4CCCC4

InChI

InChI=1S/C20H23N5OS2/c1-14-11-15(6-7-17(14)25-8-2-3-9-25)21-19(26)13-28-20-22-18(23-24-20)12-16-5-4-10-27-16/h4-7,10-11H,2-3,8-9,12-13H2,1H3,(H,21,26)(H,22,23,24)