methyl 2-[1-[C-(4-tert-butylphenyl)carbonimidoyl]sulfanylcyclopropyl]-2-chloranyl-ethanoate

Systemtic Name: methyl 2-[1-[C-(4-tert-butylphenyl)carbonimidoyl]sulfanylcyclopropyl]-2-chloranyl-ethanoate Openeye Name: methyl 2-[1-(4-tert-butylbenzenecarboximidoyl)sulfanylcyclopropyl]-2-chloro-acetate CAS Name: 2-[1-[[(4-tert-butylphenyl)-iminomethyl]thio]cyclopropyl]-2-chloroacetic acid methyl ester IUPAC Name: methyl 2-[1-(4-tert-butylbenzenecarboximidoyl)sulfanylcyclopropyl]-2-chloroacetate Traditional Name: 2-[1-[(4-tert-butylbenzimidoyl)thio]cyclopropyl]-2-chloro-acetic acid methyl ester Formula: C17H22ClNO2S MolecularWeight: 339.88008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=N)SC2(CC2)C(C(=O)OC)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=N)SC2(CC2)C(C(=O)OC)Cl

InChI

InChI=1S/C17H22ClNO2S/c1-16(2,3)12-7-5-11(6-8-12)14(19)22-17(9-10-17)13(18)15(20)21-4/h5-8,13,19H,9-10H2,1-4H3