N-[(1S)-1-phenylbutyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[(1S)-1-phenylbutyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(1S)-1-phenylbutyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[(1S)-1-phenylbutyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[(1S)-1-phenylbutyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[(1S)-1-phenylbutyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C18H20N4OS2 MolecularWeight: 372.5076

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)NC(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C18H20N4OS2/c1-2-7-14(13-8-4-3-5-9-13)19-16(23)12-22-17(20-21-18(22)24)15-10-6-11-25-15/h3-6,8-11,14H,2,7,12H2,1H3,(H,19,23)(H,21,24)/t14-/m0/s1