N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(phenylsulfonyl)butanamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)butanamide CAS Name: 4-(benzenesulfonyl)-N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)butanamide Traditional Name: 4-besyl-N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)butyramide Formula: C24H30ClN3O3S2 MolecularWeight: 508.0963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(C=CC(=C2S1)Cl)C)C(=O)CCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(C=CC(=C2S1)Cl)C)C(=O)CCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H30ClN3O3S2/c1-4-27(5-2)15-16-28(24-26-22-18(3)13-14-20(25)23(22)32-24)21(29)12-9-17-33(30,31)19-10-7-6-8-11-19/h6-8,10-11,13-14H,4-5,9,12,15-17H2,1-3H3