N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-4-(p-tolylsulfanyl)butanamide CAS Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-(2-diethylaminoethyl)-N-(4-methoxy-1,3-benzothiazol-2-yl)-4-(p-tolylthio)butyramide Formula: C25H33N3O2S2 MolecularWeight: 471.67842

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(C=CC=C2S1)OC)C(=O)CCCSC3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(C=CC=C2S1)OC)C(=O)CCCSC3=CC=C(C=C3)C

InChI

InChI=1S/C25H33N3O2S2/c1-5-27(6-2)16-17-28(25-26-24-21(30-4)9-7-10-22(24)32-25)23(29)11-8-18-31-20-14-12-19(3)13-15-20/h7,9-10,12-15H,5-6,8,11,16-18H2,1-4H3