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

Systemtic Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-3,4-diethoxy-N-(4-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C23H29N3O5S2 MolecularWeight: 491.62346

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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=CC=C3S(=O)(=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3S(=O)(=O)C)OCC

InChI

InChI=1S/C23H29N3O5S2/c1-6-30-17-12-11-16(15-18(17)31-7-2)22(27)26(14-13-25(3)4)23-24-21-19(32-23)9-8-10-20(21)33(5,28)29/h8-12,15H,6-7,13-14H2,1-5H3