tert-butyl N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(2Z)-2-(quinolin-6-ylmethylidene)hydrazinyl]butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(2Z)-2-(quinolin-6-ylmethylidene)hydrazinyl]butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-3-methylsulfanyl-1-[[(Z)-6-quinolylmethyleneamino]carbamoyl]propyl]carbamate CAS Name: N-[(2S)-4-(methylthio)-1-oxo-1-[(2Z)-2-(6-quinolinylmethylidene)hydrazinyl]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4-methylsulfanyl-1-oxo-1-[(2Z)-2-(quinolin-6-ylmethylidene)hydrazinyl]butan-2-yl]carbamate Traditional Name: N-[(1S)-3-(methylthio)-1-[[(Z)-6-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=CC2=C(C=C1)N=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O3S/c1-20(2,3)27-19(26)23-17(9-11-28-4)18(25)24-22-13-14-7-8-16-15(12-14)6-5-10-21-16/h5-8,10,12-13,17H,9,11H2,1-4H3,(H,23,26)(H,24,25)/b22-13-/t17-/m0/s1