N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-[(4-methoxyphenyl)thio]propionamide Formula: C21H24BrN3O2S2 MolecularWeight: 494.46816

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)CCSC3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)CCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24BrN3O2S2/c1-24(2)11-12-25(21-23-18-9-4-15(22)14-19(18)29-21)20(26)10-13-28-17-7-5-16(27-3)6-8-17/h4-9,14H,10-13H2,1-3H3