2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]ethanamide

Systemtic Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]ethanamide Openeye Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]acetamide CAS Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]acetamide IUPAC Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]acetamide Traditional Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-N-[(6-pyrrolidino-3-pyridyl)methyl]acetamide Formula: C17H24N6OS MolecularWeight: 360.47706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N6OS/c1-2-5-15-20-21-17(25)23(15)12-16(24)19-11-13-6-7-14(18-10-13)22-8-3-4-9-22/h6-7,10H,2-5,8-9,11-12H2,1H3,(H,19,24)(H,21,25)