N-(2-dimethylaminoethyl)-2-ethylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-ethylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-2-ethylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-2-ethylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-dimethylaminoethyl)-2-ethylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-2-esyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C21H25N3O3S2/c1-5-29(26,27)19-9-7-6-8-16(19)20(25)24(13-12-23(3)4)21-22-17-11-10-15(2)14-18(17)28-21/h6-11,14H,5,12-13H2,1-4H3