N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3,4-dimethyl-benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3,4-dimethyl-benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3,4-dimethyl-benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3,4-dimethylbenzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3,4-dimethylbenzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3,4-dimethyl-benzamide Formula: C22H26BrN3OS MolecularWeight: 460.43034

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H26BrN3OS/c1-5-25(6-2)11-12-26(21(27)17-8-7-15(3)16(4)13-17)22-24-19-10-9-18(23)14-20(19)28-22/h7-10,13-14H,5-6,11-12H2,1-4H3