cyclopentyl 1-[(4-tert-butylphenyl)methylsulfanyl]-N-pyridin-3-yl-methanimidate

Systemtic Name: cyclopentyl 1-[(4-tert-butylphenyl)methylsulfanyl]-N-pyridin-3-yl-methanimidate Openeye Name: cyclopentyl 1-[(4-tert-butylphenyl)methylsulfanyl]-N-(3-pyridyl)methanimidate CAS Name: 1-[(4-tert-butylphenyl)methylthio]-N-(3-pyridinyl)methanimidic acid cyclopentyl ester IUPAC Name: cyclopentyl 1-[(4-tert-butylphenyl)methylsulfanyl]-N-pyridin-3-ylmethanimidate Traditional Name: 1-[(4-tert-butylbenzyl)thio]-N-(3-pyridyl)formimidic acid cyclopentyl ester Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC(=NC2=CN=CC=C2)OC3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC(=NC2=CN=CC=C2)OC3CCCC3

InChI

InChI=1S/C22H28N2OS/c1-22(2,3)18-12-10-17(11-13-18)16-26-21(25-20-8-4-5-9-20)24-19-7-6-14-23-15-19/h6-7,10-15,20H,4-5,8-9,16H2,1-3H3