1-cyclopentyl-4-[4-phenoxy-2,6-di(propan-2-yl)phenyl]-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-cyclopentyl-4-[4-phenoxy-2,6-di(propan-2-yl)phenyl]-1,2,3,4-tetrazole-5-thione Openeye Name: 1-cyclopentyl-4-(2,6-diisopropyl-4-phenoxy-phenyl)tetrazole-5-thione CAS Name: 1-cyclopentyl-4-[4-phenoxy-2,6-di(propan-2-yl)phenyl]-5-tetrazolethione IUPAC Name: 1-cyclopentyl-4-[4-phenoxy-2,6-di(propan-2-yl)phenyl]tetrazole-5-thione Traditional Name: 1-cyclopentyl-4-(2,6-diisopropyl-4-phenoxy-phenyl)tetrazole-5-thione Formula: C24H30N4OS MolecularWeight: 422.5862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1N2C(=S)N(N=N2)C3CCCC3)C(C)C)OC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC(=CC(=C1N2C(=S)N(N=N2)C3CCCC3)C(C)C)OC4=CC=CC=C4

InChI

InChI=1S/C24H30N4OS/c1-16(2)21-14-20(29-19-12-6-5-7-13-19)15-22(17(3)4)23(21)28-24(30)27(25-26-28)18-10-8-9-11-18/h5-7,12-18H,8-11H2,1-4H3