N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonyl-benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonyl-benzamide Openeye Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonyl-benzamide CAS Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonylbenzamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonylbenzamide Traditional Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-esyl-benzamide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN(C)C)C2=NC3=CC(=CC(=C3S2)C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN(C)C)C2=NC3=CC(=CC(=C3S2)C)C

InChI

InChI=1S/C22H27N3O3S2/c1-6-30(27,28)19-10-8-7-9-17(19)21(26)25(12-11-24(4)5)22-23-18-14-15(2)13-16(3)20(18)29-22/h7-10,13-14H,6,11-12H2,1-5H3