N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(p-tolylthio)propionamide Formula: C21H24ClN3OS2 MolecularWeight: 434.01776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C21H24ClN3OS2/c1-15-7-9-16(10-8-15)27-14-11-19(26)25(13-12-24(2)3)21-23-20-17(22)5-4-6-18(20)28-21/h4-10H,11-14H2,1-3H3