2-[[5-(1-adamantylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[[5-(1-adamantylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[[5-(1-adamantylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[[5-(1-adamantylmethyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[[5-(1-adamantylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[[5-(1-adamantylmethyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(3-methoxyphenyl)acetamide Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)OC)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)OC)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H30N4O2S/c1-27-20(13-23-10-15-6-16(11-23)8-17(7-15)12-23)25-26-22(27)30-14-21(28)24-18-4-3-5-19(9-18)29-2/h3-5,9,15-17H,6-8,10-14H2,1-2H3,(H,24,28)