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

Systemtic Name: 1-(5-bromanyl-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-4-carboxamide Openeye Name: 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-4-carboxamide CAS Name: 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,4-dimethylphenyl)piperidine-4-carboxamide Traditional Name: 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,4-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=C(C=C(C=C4)C)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C23H26BrN3O2S/c1-4-29-20-13-21-19(12-17(20)24)26-23(30-21)27-9-7-16(8-10-27)22(28)25-18-6-5-14(2)11-15(18)3/h5-6,11-13,16H,4,7-10H2,1-3H3,(H,25,28)