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

Systemtic Name: N-[(2R)-4-phenylbutan-2-yl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[(2R)-4-phenylbutan-2-yl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[(2R)-4-phenylbutan-2-yl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[(1R)-1-methyl-3-phenyl-propyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H22N4OS2 MolecularWeight: 386.53418

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C19H22N4OS2/c1-14(9-10-15-6-3-2-4-7-15)20-17(24)11-12-23-18(21-22-19(23)25)16-8-5-13-26-16/h2-8,13-14H,9-12H2,1H3,(H,20,24)(H,22,25)/t14-/m1/s1