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

Systemtic Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)propanamide Openeye Name: 3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(3-oxo-3-pyrrolidin-1-yl-propyl)propanamide CAS Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[3-oxo-3-(1-pyrrolidinyl)propyl]propanamide IUPAC Name: 3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide Traditional Name: N-(3-keto-3-pyrrolidino-propyl)-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NCCC(=O)N3CCCC3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NCCC(=O)N3CCCC3

InChI

InChI=1S/C19H25N5O2S/c1-14-5-4-6-15(13-14)18-21-22-19(27)24(18)12-8-16(25)20-9-7-17(26)23-10-2-3-11-23/h4-6,13H,2-3,7-12H2,1H3,(H,20,25)(H,22,27)