tert-butyl N-[4-[2-[1-(4-methylsulfanylphenyl)ethylamino]-2-oxidanylidene-ethyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[2-[1-(4-methylsulfanylphenyl)ethylamino]-2-oxidanylidene-ethyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[2-[1-(4-methylsulfanylphenyl)ethylamino]-2-oxo-ethyl]phenyl]carbamate CAS Name: N-[4-[2-[1-[4-(methylthio)phenyl]ethylamino]-2-oxoethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[2-[1-(4-methylsulfanylphenyl)ethylamino]-2-oxoethyl]phenyl]carbamate Traditional Name: N-[4-[2-keto-2-[1-[4-(methylthio)phenyl]ethylamino]ethyl]phenyl]carbamic acid tert-butyl ester Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)NC(=O)CC2=CC=C(C=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C1=CC=C(C=C1)SC)NC(=O)CC2=CC=C(C=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H28N2O3S/c1-15(17-8-12-19(28-5)13-9-17)23-20(25)14-16-6-10-18(11-7-16)24-21(26)27-22(2,3)4/h6-13,15H,14H2,1-5H3,(H,23,25)(H,24,26)