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

Systemtic Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide CAS Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[[4-(1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-N-(4-pyrrolidinobenzyl)acetamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NCC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NCC2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C18H25N5OS/c1-2-5-16-20-21-18(25)23(16)13-17(24)19-12-14-6-8-15(9-7-14)22-10-3-4-11-22/h6-9H,2-5,10-13H2,1H3,(H,19,24)(H,21,25)