2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N,2-diphenyl-ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N,2-diphenyl-ethanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N,2-diphenyl-acetamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N,2-diphenylacetamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N,2-diphenylacetamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N,2-diphenyl-acetamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SC(C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SC(C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H25N5OS/c23-27-20(17-12-6-2-7-13-17)25-26-22(27)29-19(16-10-4-1-5-11-16)21(28)24-18-14-8-3-9-15-18/h1,3-5,8-11,14-15,17,19H,2,6-7,12-13,23H2,(H,24,28)