N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-(phenylsulfonyl)butanamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)butanamide CAS Name: 4-(benzenesulfonyl)-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)butanamide Traditional Name: 4-besyl-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)butyramide Formula: C22H26ClN3O3S2 MolecularWeight: 480.04314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O3S2/c1-16-14-17(23)15-19-21(16)24-22(30-19)26(12-11-25(2)3)20(27)10-7-13-31(28,29)18-8-5-4-6-9-18/h4-6,8-9,14-15H,7,10-13H2,1-3H3