N-[(1-phenylcyclobutyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[(1-phenylcyclobutyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[(1-phenylcyclobutyl)methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[(1-phenylcyclobutyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[(1-phenylcyclobutyl)methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[(1-phenylcyclobutyl)methyl]-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(C1)(CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CC(C1)(CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3)C4=CC=CC=C4

InChI

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