N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C23H29N3O3S2 MolecularWeight: 459.62466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)SC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)SC)OCC

InChI

InChI=1S/C23H29N3O3S2/c1-6-28-19-11-8-16(14-20(19)29-7-2)22(27)26(13-12-25(3)4)23-24-18-10-9-17(30-5)15-21(18)31-23/h8-11,14-15H,6-7,12-13H2,1-5H3