2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-propan-2-yloxypropyl)ethanamide

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-propan-2-yloxypropyl)ethanamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-isopropoxypropyl)acetamide CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(3-propan-2-yloxypropyl)acetamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-propan-2-yloxypropyl)acetamide Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(3-isopropoxypropyl)acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)OCCCNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2S/c1-17(2)28-15-9-14-23-20(27)16-29-22-25-24-21(18-10-5-3-6-11-18)26(22)19-12-7-4-8-13-19/h3-8,10-13,17H,9,14-16H2,1-2H3,(H,23,27)