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

Systemtic Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-N-[2-(pyrrolidinomethyl)benzyl]acetamide Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NCC2=CC=CC=C2CN3CCCC3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NCC2=CC=CC=C2CN3CCCC3

InChI

InChI=1S/C19H27N5OS/c1-2-7-17-21-22-19(26)24(17)14-18(25)20-12-15-8-3-4-9-16(15)13-23-10-5-6-11-23/h3-4,8-9H,2,5-7,10-14H2,1H3,(H,20,25)(H,22,26)