1-[2-(4-chlorophenyl)pyrrolidin-1-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanone

Systemtic Name: 1-[2-(4-chlorophenyl)pyrrolidin-1-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanone Openeye Name: 1-[2-(4-chlorophenyl)pyrrolidin-1-yl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)ethanone CAS Name: 1-[2-(4-chlorophenyl)-1-pyrrolidinyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanone IUPAC Name: 1-[2-(4-chlorophenyl)pyrrolidin-1-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanone Traditional Name: 1-[2-(4-chlorophenyl)pyrrolidino]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)ethanone Formula: C17H21ClN4OS MolecularWeight: 364.89284

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)N2CCCC2C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)N2CCCC2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H21ClN4OS/c1-2-4-15-19-20-17(24)22(15)11-16(23)21-10-3-5-14(21)12-6-8-13(18)9-7-12/h6-9,14H,2-5,10-11H2,1H3,(H,20,24)