N-(2-dimethylaminoethyl)-3-(4-methylphenyl)sulfanyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: N-(2-dimethylaminoethyl)-3-(4-methylphenyl)sulfanyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: N-(2-dimethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(2-dimethylaminoethyl)-3-[(4-methylphenyl)thio]-N-[6-(methylthio)-1,3-benzothiazol-2-yl]propanamide IUPAC Name: N-(2-dimethylaminoethyl)-3-(4-methylphenyl)sulfanyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(2-dimethylaminoethyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-3-(p-tolylthio)propionamide Formula: C22H27N3OS3 MolecularWeight: 445.66428

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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=C(C=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)SC

InChI

InChI=1S/C22H27N3OS3/c1-16-5-7-17(8-6-16)28-14-11-21(26)25(13-12-24(2)3)22-23-19-10-9-18(27-4)15-20(19)29-22/h5-10,15H,11-14H2,1-4H3