4-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]methyl]-N-phenyl-benzamide Formula: C24H22N4OS2 MolecularWeight: 446.58768

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)CC5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C24H22N4OS2/c29-23(25-19-5-2-1-3-6-19)18-10-8-17(9-11-18)16-31-24-27-26-22(28(24)20-12-13-20)15-21-7-4-14-30-21/h1-11,14,20H,12-13,15-16H2,(H,25,29)