N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-(4-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-(p-tolylsulfanyl)acetamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-(p-tolylthio)acetamide Formula: C21H24ClN3O2S2 MolecularWeight: 450.01716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)N(CCN(C)C)C2=NC3=C(C=CC(=C3S2)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N(CCN(C)C)C2=NC3=C(C=CC(=C3S2)Cl)OC

InChI

InChI=1S/C21H24ClN3O2S2/c1-14-5-7-15(8-6-14)28-13-18(26)25(12-11-24(2)3)21-23-19-17(27-4)10-9-16(22)20(19)29-21/h5-10H,11-13H2,1-4H3