tert-butyl N-[4-[4-(2-bromanylethanoylamino)phenyl]-1,3-thiazol-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[4-(2-bromanylethanoylamino)phenyl]-1,3-thiazol-2-yl]carbamate Openeye Name: tert-butyl N-[4-[4-[(2-bromoacetyl)amino]phenyl]thiazol-2-yl]carbamate CAS Name: N-[4-[4-[(2-bromo-1-oxoethyl)amino]phenyl]-2-thiazolyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-[(2-bromoacetyl)amino]phenyl]-1,3-thiazol-2-yl]carbamate Traditional Name: N-[4-[4-[(2-bromoacetyl)amino]phenyl]thiazol-2-yl]carbamic acid tert-butyl ester Formula: C16H18BrN3O3S MolecularWeight: 412.30142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)CBr

Isomeric SMILES

CC(C)(C)OC(=O)NC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)CBr

InChI

InChI=1S/C16H18BrN3O3S/c1-16(2,3)23-15(22)20-14-19-12(9-24-14)10-4-6-11(7-5-10)18-13(21)8-17/h4-7,9H,8H2,1-3H3,(H,18,21)(H,19,20,22)