3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)propanamide

Systemtic Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)propanamide Openeye Name: 3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)propanamide CAS Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]propanamide IUPAC Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide Traditional Name: N-(2-keto-2-pyrrolidino-ethyl)-3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propionamide Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC(=O)N3CCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC(=O)N3CCCC3

InChI

InChI=1S/C19H25N5O3S/c1-2-27-15-7-5-14(6-8-15)18-21-22-19(28)24(18)12-9-16(25)20-13-17(26)23-10-3-4-11-23/h5-8H,2-4,9-13H2,1H3,(H,20,25)(H,22,28)