N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-phenylsulfanyl-butanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-phenylsulfanyl-butanamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-(phenylthio)butanamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-phenylsulfanylbutanamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-(phenylthio)butyramide Formula: C21H24ClN3OS2 MolecularWeight: 434.01776

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C21H24ClN3OS2/c1-24(2)13-14-25(21-23-20-17(22)10-6-11-18(20)28-21)19(26)12-7-15-27-16-8-4-3-5-9-16/h3-6,8-11H,7,12-15H2,1-2H3