N-[(3-phenoxyphenyl)methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[(3-phenoxyphenyl)methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(3-phenoxyphenyl)methyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[(3-phenoxyphenyl)methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[(3-phenoxyphenyl)methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(3-phenoxybenzyl)-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NCC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2S/c1-2-7-18-22-23-20(27)24(18)14-19(25)21-13-15-8-6-11-17(12-15)26-16-9-4-3-5-10-16/h3-6,8-12H,2,7,13-14H2,1H3,(H,21,25)(H,23,27)