tert-butyl N-[(3S)-2-(2-azanyl-5-nitro-phenyl)imino-5-oxidanylidene-thiolan-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3S)-2-(2-azanyl-5-nitro-phenyl)imino-5-oxidanylidene-thiolan-3-yl]carbamate Openeye Name: tert-butyl N-[(3S)-2-(2-amino-5-nitro-phenyl)imino-5-oxo-tetrahydrothiophen-3-yl]carbamate CAS Name: N-[(3S)-2-(2-amino-5-nitrophenyl)imino-5-oxo-3-thiolanyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S)-2-(2-amino-5-nitrophenyl)imino-5-oxothiolan-3-yl]carbamate Traditional Name: N-[(3S)-2-(2-amino-5-nitro-phenyl)imino-5-keto-tetrahydrothiophen-3-yl]carbamic acid tert-butyl ester Formula: C15H18N4O5S MolecularWeight: 366.39222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC(=O)SC1=NC2=C(C=CC(=C2)[N+](=O)[O-])N

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H]1CC(=O)SC1=NC2=C(C=CC(=C2)[N+](=O)[O-])N

InChI

InChI=1S/C15H18N4O5S/c1-15(2,3)24-14(21)18-11-7-12(20)25-13(11)17-10-6-8(19(22)23)4-5-9(10)16/h4-6,11H,7,16H2,1-3H3,(H,18,21)/t11-/m0/s1