2-[3-(benzotriazol-1-ylmethyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-cyclohexyl-ethanamide

Systemtic Name: 2-[3-(benzotriazol-1-ylmethyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-cyclohexyl-ethanamide Openeye Name: 2-[3-(benzotriazol-1-ylmethyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]-N-cyclohexyl-acetamide CAS Name: 2-[3-(1-benzotriazolylmethyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-cyclohexylacetamide IUPAC Name: 2-[3-(benzotriazol-1-ylmethyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-cyclohexylacetamide Traditional Name: 2-[3-(benzotriazol-1-ylmethyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]-N-cyclohexyl-acetamide Formula: C23H25N7OS MolecularWeight: 447.5559

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN2C(=S)N(C(=N2)CN3C4=CC=CC=C4N=N3)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)CN2C(=S)N(C(=N2)CN3C4=CC=CC=C4N=N3)C5=CC=CC=C5

InChI

InChI=1S/C23H25N7OS/c31-22(24-17-9-3-1-4-10-17)16-29-23(32)30(18-11-5-2-6-12-18)21(26-29)15-28-20-14-8-7-13-19(20)25-27-28/h2,5-8,11-14,17H,1,3-4,9-10,15-16H2,(H,24,31)