N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-[(4-methoxyphenyl)thio]propionamide Formula: C24H30ClN3O2S2 MolecularWeight: 492.0969

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(C=CC(=C2S1)Cl)C)C(=O)CCSC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(C=CC(=C2S1)Cl)C)C(=O)CCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C24H30ClN3O2S2/c1-5-27(6-2)14-15-28(24-26-22-17(3)7-12-20(25)23(22)32-24)21(29)13-16-31-19-10-8-18(30-4)9-11-19/h7-12H,5-6,13-16H2,1-4H3