(3,5-dimethylcyclohexyl) 1-[(4-tert-butylphenyl)methylsulfanyl]-N-pyridin-3-yl-methanimidate

Systemtic Name: (3,5-dimethylcyclohexyl) 1-[(4-tert-butylphenyl)methylsulfanyl]-N-pyridin-3-yl-methanimidate Openeye Name: (3,5-dimethylcyclohexyl) 1-[(4-tert-butylphenyl)methylsulfanyl]-N-(3-pyridyl)methanimidate CAS Name: 1-[(4-tert-butylphenyl)methylthio]-N-(3-pyridinyl)methanimidic acid (3,5-dimethylcyclohexyl) ester IUPAC Name: (3,5-dimethylcyclohexyl) 1-[(4-tert-butylphenyl)methylsulfanyl]-N-pyridin-3-ylmethanimidate Traditional Name: 1-[(4-tert-butylbenzyl)thio]-N-(3-pyridyl)formimidic acid (3,5-dimethylcyclohexyl) ester Formula: C25H34N2OS MolecularWeight: 410.61526

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)OC(=NC2=CN=CC=C2)SCC3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CC1CC(CC(C1)OC(=NC2=CN=CC=C2)SCC3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C25H34N2OS/c1-18-13-19(2)15-23(14-18)28-24(27-22-7-6-12-26-16-22)29-17-20-8-10-21(11-9-20)25(3,4)5/h6-12,16,18-19,23H,13-15,17H2,1-5H3