N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-(phenylsulfonyl)butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]butanamide CAS Name: 4-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-[3-(dimethylamino)propyl]butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-besyl-N-[3-(dimethylamino)propyl]butyramide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(C1=NC2=CC=CC=C2S1)C(=O)CCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCCN(C1=NC2=CC=CC=C2S1)C(=O)CCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S2/c1-24(2)15-9-16-25(22-23-19-12-6-7-13-20(19)29-22)21(26)14-8-17-30(27,28)18-10-4-3-5-11-18/h3-7,10-13H,8-9,14-17H2,1-2H3