tert-butyl N-[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-3-(quinolin-2-ylmethylsulfanyl)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-3-(quinolin-2-ylmethylsulfanyl)propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[(4-methoxyphenyl)methylamino]-2-oxo-1-(2-quinolylmethylsulfanylmethyl)ethyl]carbamate CAS Name: N-[1-[(4-methoxyphenyl)methylamino]-1-oxo-3-(2-quinolinylmethylthio)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(4-methoxyphenyl)methylamino]-1-oxo-3-(quinolin-2-ylmethylsulfanyl)propan-2-yl]carbamate Traditional Name: N-[2-keto-2-(p-anisylamino)-1-[(2-quinolylmethylthio)methyl]ethyl]carbamic acid tert-butyl ester Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC1=NC2=CC=CC=C2C=C1)C(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSCC1=NC2=CC=CC=C2C=C1)C(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H31N3O4S/c1-26(2,3)33-25(31)29-23(24(30)27-15-18-9-13-21(32-4)14-10-18)17-34-16-20-12-11-19-7-5-6-8-22(19)28-20/h5-14,23H,15-17H2,1-4H3,(H,27,30)(H,29,31)