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

Systemtic Name: N-cyclopropyl-4-[[4-ethyl-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Openeye Name: N-cyclopropyl-4-[[4-ethyl-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide CAS Name: N-cyclopropyl-4-[[[4-ethyl-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]methyl]benzamide IUPAC Name: N-cyclopropyl-4-[[4-ethyl-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Traditional Name: N-cyclopropyl-4-[[[4-ethyl-5-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]methyl]benzamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)C(=O)NC3CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)C(=O)NC3CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C22H24N4O2S/c1-3-26-20(17-5-4-6-19(13-17)28-2)24-25-22(26)29-14-15-7-9-16(10-8-15)21(27)23-18-11-12-18/h4-10,13,18H,3,11-12,14H2,1-2H3,(H,23,27)