N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-propanamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-propanamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-propanamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonylpropanamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonylpropanamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-propionamide Formula: C22H26ClN3O4S2 MolecularWeight: 496.04254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)N(CCN(C)C)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)N(CCN(C)C)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C22H26ClN3O4S2/c1-15-13-16(23)14-19-21(15)24-22(31-19)26(11-10-25(2)3)20(27)9-12-32(28,29)18-7-5-17(30-4)6-8-18/h5-8,13-14H,9-12H2,1-4H3