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

Systemtic Name: tert-butyl N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[2-(quinoxalin-6-ylmethylidene)hydrazinyl]butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-3-methylsulfanyl-1-[(quinoxalin-6-ylmethyleneamino)carbamoyl]propyl]carbamate CAS Name: N-[(2S)-4-(methylthio)-1-oxo-1-[2-(6-quinoxalinylmethylidene)hydrazinyl]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4-methylsulfanyl-1-oxo-1-[2-(quinoxalin-6-ylmethylidene)hydrazinyl]butan-2-yl]carbamate Traditional Name: N-[(1S)-3-(methylthio)-1-[(quinoxalin-6-ylmethyleneamino)carbamoyl]propyl]carbamic acid tert-butyl ester Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCSC)C(=O)NN=CC1=CC2=NC=CN=C2C=C1

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCSC)C(=O)NN=CC1=CC2=NC=CN=C2C=C1

InChI

InChI=1S/C19H25N5O3S/c1-19(2,3)27-18(26)23-15(7-10-28-4)17(25)24-22-12-13-5-6-14-16(11-13)21-9-8-20-14/h5-6,8-9,11-12,15H,7,10H2,1-4H3,(H,23,26)(H,24,25)/t15-/m0/s1