1-(5-bromanyl-6-ethoxy-1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-bromanyl-6-ethoxy-1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-4-carboxamide Openeye Name: 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-4-carboxamide CAS Name: 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-4-carboxamide Traditional Name: 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)isonipecotamide Formula: C23H26BrN3O2S MolecularWeight: 488.44044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)SC(=N2)N3CCC(CC3)C(=O)NC4=CC(=CC(=C4)C)C)Br

Isomeric SMILES

CCOC1=C(C=C2C(=C1)SC(=N2)N3CCC(CC3)C(=O)NC4=CC(=CC(=C4)C)C)Br

InChI

InChI=1S/C23H26BrN3O2S/c1-4-29-20-13-21-19(12-18(20)24)26-23(30-21)27-7-5-16(6-8-27)22(28)25-17-10-14(2)9-15(3)11-17/h9-13,16H,4-8H2,1-3H3,(H,25,28)