ethyl 4-[(5-bromanyl-6-methoxy-1,3-benzothiazol-2-yl)methylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(5-bromanyl-6-methoxy-1,3-benzothiazol-2-yl)methylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(5-bromo-6-methoxy-1,3-benzothiazol-2-yl)methylamino]piperidine-1-carboxylate CAS Name: 4-[(5-bromo-6-methoxy-1,3-benzothiazol-2-yl)methylamino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-bromo-6-methoxy-1,3-benzothiazol-2-yl)methylamino]piperidine-1-carboxylate Traditional Name: 4-[(5-bromo-6-methoxy-1,3-benzothiazol-2-yl)methylamino]piperidine-1-carboxylic acid ethyl ester Formula: C17H22BrN3O3S MolecularWeight: 428.34388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NCC2=NC3=CC(=C(C=C3S2)OC)Br

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NCC2=NC3=CC(=C(C=C3S2)OC)Br

InChI

InChI=1S/C17H22BrN3O3S/c1-3-24-17(22)21-6-4-11(5-7-21)19-10-16-20-13-8-12(18)14(23-2)9-15(13)25-16/h8-9,11,19H,3-7,10H2,1-2H3