N-cyclopropyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide

Systemtic Name: N-cyclopropyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: N-cyclopropyl-2-[[4-isopentyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: N-cyclopropyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: N-cyclopropyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide Traditional Name: N-cyclopropyl-2-[[4-isoamyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]-2-phenyl-acetamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)NC3CC3)COC4=CC=CC=C4

Isomeric SMILES

CC(C)CCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)NC3CC3)COC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2S/c1-18(2)15-16-29-22(17-31-21-11-7-4-8-12-21)27-28-25(29)32-23(19-9-5-3-6-10-19)24(30)26-20-13-14-20/h3-12,18,20,23H,13-17H2,1-2H3,(H,26,30)