tert-butyl N-[1-[4-(2-methylsulfanylphenyl)phenyl]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-[4-(2-methylsulfanylphenyl)phenyl]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]carbamate Openeye Name: tert-butyl N-[1-[4-(2-methylsulfanylphenyl)phenyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]carbamate CAS Name: N-[1-[4-[2-(methylthio)phenyl]phenyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-(2-methylsulfanylphenyl)phenyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]carbamate Traditional Name: N-[2-keto-1-[4-[2-(methylthio)phenyl]phenyl]-4,5-dihydro-3H-1-benzazepin-3-yl]carbamic acid tert-butyl ester Formula: C28H30N2O3S MolecularWeight: 474.6144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC2=CC=CC=C2N(C1=O)C3=CC=C(C=C3)C4=CC=CC=C4SC

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC2=CC=CC=C2N(C1=O)C3=CC=C(C=C3)C4=CC=CC=C4SC

InChI

InChI=1S/C28H30N2O3S/c1-28(2,3)33-27(32)29-23-18-15-20-9-5-7-11-24(20)30(26(23)31)21-16-13-19(14-17-21)22-10-6-8-12-25(22)34-4/h5-14,16-17,23H,15,18H2,1-4H3,(H,29,32)