N-cyclohexyl-3-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-cyclohexyl-3-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclohexyl-propanamide CAS Name: N-cyclohexyl-3-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclohexylpropanamide Traditional Name: 3-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-cyclohexyl-propionamide Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCSC2=NN=C(N2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)CCSC2=NN=C(N2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4OS/c29-23(25-20-12-6-2-7-13-20)16-17-30-24-27-26-22(18-19-10-4-1-5-11-19)28(24)21-14-8-3-9-15-21/h1,3-5,8-11,14-15,20H,2,6-7,12-13,16-18H2,(H,25,29)