N-(4-methoxyphenyl)-4-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(4-methoxyphenyl)-4-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: N-(4-methoxyphenyl)-4-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide CAS Name: N-(4-methoxyphenyl)-4-[[(5-propyl-1H-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-(4-methoxyphenyl)-4-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: N-(4-methoxyphenyl)-4-[[(5-propyl-1H-1,2,4-triazol-3-yl)thio]methyl]benzamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCCC1=NC(=NN1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N4O2S/c1-3-4-18-22-20(24-23-18)27-13-14-5-7-15(8-6-14)19(25)21-16-9-11-17(26-2)12-10-16/h5-12H,3-4,13H2,1-2H3,(H,21,25)(H,22,23,24)