tert-butyl 4-(7-bromanyl-4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(7-bromanyl-4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(7-bromo-4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carboxylate CAS Name: 4-(7-bromo-4-methoxy-1,3-benzothiazol-2-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(7-bromo-4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carboxylate Traditional Name: 4-(7-bromo-4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C17H22BrN3O3S MolecularWeight: 428.34388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=C(C=CC(=C3S2)Br)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=C(C=CC(=C3S2)Br)OC

InChI

InChI=1S/C17H22BrN3O3S/c1-17(2,3)24-16(22)21-9-7-20(8-10-21)15-19-13-12(23-4)6-5-11(18)14(13)25-15/h5-6H,7-10H2,1-4H3