tert-butyl N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(2E)-2-(quinolin-8-ylmethylidene)hydrazinyl]butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(2E)-2-(quinolin-8-ylmethylidene)hydrazinyl]butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-3-methylsulfanyl-1-[[(E)-8-quinolylmethyleneamino]carbamoyl]propyl]carbamate CAS Name: N-[(2S)-4-(methylthio)-1-oxo-1-[(2E)-2-(8-quinolinylmethylidene)hydrazinyl]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4-methylsulfanyl-1-oxo-1-[(2E)-2-(quinolin-8-ylmethylidene)hydrazinyl]butan-2-yl]carbamate Traditional Name: N-[(1S)-3-(methylthio)-1-[[(E)-8-quinolylmethyleneamino]carbamoyl]propyl]carbamic acid tert-butyl ester Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCSC)C(=O)NN=CC1=CC=CC2=C1N=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCSC)C(=O)N/N=C/C1=CC=CC2=C1N=CC=C2

InChI

InChI=1S/C20H26N4O3S/c1-20(2,3)27-19(26)23-16(10-12-28-4)18(25)24-22-13-15-8-5-7-14-9-6-11-21-17(14)15/h5-9,11,13,16H,10,12H2,1-4H3,(H,23,26)(H,24,25)/b22-13+/t16-/m0/s1