N-(3-methyl-2-phenyl-butyl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-(3-methyl-2-phenyl-butyl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-(3-methyl-2-phenyl-butyl)-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-(3-methyl-2-phenylbutyl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-(3-methyl-2-phenylbutyl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(3-methyl-2-phenyl-butyl)-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C18H26N4OS MolecularWeight: 346.49024

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NCC(C2=CC=CC=C2)C(C)C

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NCC(C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C18H26N4OS/c1-4-8-16-20-21-18(24)22(16)12-17(23)19-11-15(13(2)3)14-9-6-5-7-10-14/h5-7,9-10,13,15H,4,8,11-12H2,1-3H3,(H,19,23)(H,21,24)