N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-3-[(4-methoxyphenyl)thio]propionamide Formula: C22H26BrN3O2S2 MolecularWeight: 508.49474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26BrN3O2S2/c1-25(2)12-4-13-26(22-24-19-10-5-16(23)15-20(19)30-22)21(27)11-14-29-18-8-6-17(28-3)7-9-18/h5-10,15H,4,11-14H2,1-3H3