tert-butyl N-[2-(3-nitroimidazo[1,2-a]pyridin-8-yl)sulfanylethyl]carbamate

Systemtic Name: tert-butyl N-[2-(3-nitroimidazo[1,2-a]pyridin-8-yl)sulfanylethyl]carbamate Openeye Name: tert-butyl N-[2-(3-nitroimidazo[1,2-a]pyridin-8-yl)sulfanylethyl]carbamate CAS Name: N-[2-[(3-nitro-8-imidazo[1,2-a]pyridinyl)thio]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(3-nitroimidazo[1,2-a]pyridin-8-yl)sulfanylethyl]carbamate Traditional Name: N-[2-[(3-nitroimidazo[1,2-a]pyridin-8-yl)thio]ethyl]carbamic acid tert-butyl ester Formula: C14H18N4O4S MolecularWeight: 338.38212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCSC1=CC=CN2C1=NC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCCSC1=CC=CN2C1=NC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O4S/c1-14(2,3)22-13(19)15-6-8-23-10-5-4-7-17-11(18(20)21)9-16-12(10)17/h4-5,7,9H,6,8H2,1-3H3,(H,15,19)