N-(3-phenylpropyl)-2-[[5-(3-propan-2-yloxyphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-phenylpropyl)-2-[[5-(3-propan-2-yloxyphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(3-isopropoxyphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-phenylpropyl)acetamide CAS Name: N-(3-phenylpropyl)-2-[[5-(3-propan-2-yloxyphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3-phenylpropyl)-2-[[5-(3-propan-2-yloxyphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(3-isopropoxyphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]-N-(3-phenylpropyl)acetamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)OC(C)C

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)OC(C)C

InChI

InChI=1S/C25H32N4O2S/c1-4-16-29-24(21-13-8-14-22(17-21)31-19(2)3)27-28-25(29)32-18-23(30)26-15-9-12-20-10-6-5-7-11-20/h5-8,10-11,13-14,17,19H,4,9,12,15-16,18H2,1-3H3,(H,26,30)