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

Systemtic Name: N-aminocarbonyl-2-[[4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-carbamoyl-2-[[4-cyclohexyl-5-(1-naphthylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-carbamoyl-2-[[4-cyclohexyl-5-(1-naphthalenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-carbamoyl-2-[[4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-carbamoyl-2-[[4-cyclohexyl-5-(1-naphthylmethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC(=O)N)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC(=O)N)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H25N5O2S/c23-21(29)24-20(28)14-30-22-26-25-19(27(22)17-10-2-1-3-11-17)13-16-9-6-8-15-7-4-5-12-18(15)16/h4-9,12,17H,1-3,10-11,13-14H2,(H3,23,24,28,29)