(4-tert-butylphenyl)-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[3-phenyl-5-(2-thienylmethylamino)-1,2,4-triazol-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone IUPAC Name: (4-tert-butylphenyl)-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[3-phenyl-5-(2-thenylamino)-1,2,4-triazol-1-yl]methanone Formula: C24H24N4OS MolecularWeight: 416.53856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CS4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CS4

InChI

InChI=1S/C24H24N4OS/c1-24(2,3)19-13-11-18(12-14-19)22(29)28-23(25-16-20-10-7-15-30-20)26-21(27-28)17-8-5-4-6-9-17/h4-15H,16H2,1-3H3,(H,25,26,27)