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

Systemtic Name: N-(1-naphthalen-2-ylethyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[1-(2-naphthyl)ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[1-(2-naphthalenyl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(1-naphthalen-2-ylethyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[1-(2-naphthyl)ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)NC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

CC(C1=CC2=CC=CC=C2C=C1)NC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C21H20N4OS2/c1-14(16-9-8-15-5-2-3-6-17(15)13-16)22-19(26)10-11-25-20(23-24-21(25)27)18-7-4-12-28-18/h2-9,12-14H,10-11H2,1H3,(H,22,26)(H,24,27)