N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C17H17ClN4O2S2 MolecularWeight: 408.92548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3)O

InChI

InChI=1S/C17H17ClN4O2S2/c18-12-4-1-3-11(9-12)13(23)10-19-15(24)6-7-22-16(20-21-17(22)25)14-5-2-8-26-14/h1-5,8-9,13,23H,6-7,10H2,(H,19,24)(H,21,25)