3-[[4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 3-[[4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[4-cyclohexyl-5-(1-naphthylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 3-[[4-cyclohexyl-5-(1-naphthalenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[[4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 3-[[4-cyclohexyl-5-(1-naphthylmethyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCCC(=O)N)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCCC(=O)N)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H26N4OS/c23-20(27)13-14-28-22-25-24-21(26(22)18-10-2-1-3-11-18)15-17-9-6-8-16-7-4-5-12-19(16)17/h4-9,12,18H,1-3,10-11,13-15H2,(H2,23,27)