methyl N-tert-butyl-N-[(E)-2-cyano-2-(4-methylphenyl)-1-methylsulfanyl-ethenyl]carbamate

Systemtic Name: methyl N-tert-butyl-N-[(E)-2-cyano-2-(4-methylphenyl)-1-methylsulfanyl-ethenyl]carbamate Openeye Name: methyl N-tert-butyl-N-[(E)-2-cyano-1-methylsulfanyl-2-(p-tolyl)vinyl]carbamate CAS Name: N-tert-butyl-N-[(E)-2-cyano-2-(4-methylphenyl)-1-(methylthio)ethenyl]carbamic acid methyl ester IUPAC Name: methyl N-tert-butyl-N-[(E)-2-cyano-2-(4-methylphenyl)-1-methylsulfanylethenyl]carbamate Traditional Name: N-tert-butyl-N-[(E)-2-cyano-1-(methylthio)-2-(p-tolyl)vinyl]carbamic acid methyl ester Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C(N(C(=O)OC)C(C)(C)C)SC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C(/N(C(=O)OC)C(C)(C)C)\SC)/C#N

InChI

InChI=1S/C17H22N2O2S/c1-12-7-9-13(10-8-12)14(11-18)15(22-6)19(16(20)21-5)17(2,3)4/h7-10H,1-6H3/b15-14-