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

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-ethylsulfonyl-benzamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-ethylsulfonyl-benzamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-ethylsulfonylbenzamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-ethylsulfonylbenzamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-esyl-benzamide Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3S2/c1-4-29(26,27)18-8-6-5-7-15(18)19(25)24(12-11-23(2)3)20-22-16-10-9-14(21)13-17(16)28-20/h5-10,13H,4,11-12H2,1-3H3