tert-butyl N-[[3-[(2,2-dicyano-1-methylsulfanyl-ethenyl)amino]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[3-[(2,2-dicyano-1-methylsulfanyl-ethenyl)amino]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[3-[(2,2-dicyano-1-methylsulfanyl-vinyl)amino]phenyl]methyl]carbamate CAS Name: N-[[3-[[2,2-dicyano-1-(methylthio)ethenyl]amino]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-[(2,2-dicyano-1-methylsulfanylethenyl)amino]phenyl]methyl]carbamate Traditional Name: N-[3-[[2,2-dicyano-1-(methylthio)vinyl]amino]benzyl]carbamic acid tert-butyl ester Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC(=CC=C1)NC(=C(C#N)C#N)SC

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC(=CC=C1)NC(=C(C#N)C#N)SC

InChI

InChI=1S/C17H20N4O2S/c1-17(2,3)23-16(22)20-11-12-6-5-7-14(8-12)21-15(24-4)13(9-18)10-19/h5-8,21H,11H2,1-4H3,(H,20,22)