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

Systemtic Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)ethanamide Openeye Name: 2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(3-oxo-3-pyrrolidin-1-yl-propyl)acetamide CAS Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[3-oxo-3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(3-oxo-3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: N-(3-keto-3-pyrrolidino-propyl)-2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NCCC(=O)N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NCCC(=O)N3CCCC3

InChI

InChI=1S/C18H23N5O3S/c1-26-14-6-4-13(5-7-14)17-20-21-18(27)23(17)12-15(24)19-9-8-16(25)22-10-2-3-11-22/h4-7H,2-3,8-12H2,1H3,(H,19,24)(H,21,27)