3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)propanamide

Systemtic Name: 3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)propanamide Openeye Name: N-(tetralin-1-ylmethyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: 3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)propanamide IUPAC Name: 3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)propanamide Traditional Name: N-(tetralin-1-ylmethyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C20H22N4OS2 MolecularWeight: 398.54488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)CNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)CNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C20H22N4OS2/c25-18(21-13-15-7-3-6-14-5-1-2-8-16(14)15)10-11-24-19(22-23-20(24)26)17-9-4-12-27-17/h1-2,4-5,8-9,12,15H,3,6-7,10-11,13H2,(H,21,25)(H,23,26)