2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]acetamide Formula: C23H29N3O2S2 MolecularWeight: 443.62526

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)CSCC1=NC2=CC=CC=C2S1)C3=CC(=CC=C3)OC

Isomeric SMILES

CCN(CC)C(CNC(=O)CSCC1=NC2=CC=CC=C2S1)C3=CC(=CC=C3)OC

InChI

InChI=1S/C23H29N3O2S2/c1-4-26(5-2)20(17-9-8-10-18(13-17)28-3)14-24-22(27)15-29-16-23-25-19-11-6-7-12-21(19)30-23/h6-13,20H,4-5,14-16H2,1-3H3,(H,24,27)