N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-dimethylaminoethyl)benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-dimethylaminoethyl)benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-dimethylaminoethyl)benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-dimethylaminoethyl)benzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-dimethylaminoethyl)benzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-dimethylaminoethyl)benzamide Formula: C22H26BrN3O2S MolecularWeight: 476.42974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C22H26BrN3O2S/c1-4-5-14-28-18-9-6-16(7-10-18)21(27)26(13-12-25(2)3)22-24-19-11-8-17(23)15-20(19)29-22/h6-11,15H,4-5,12-14H2,1-3H3