N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(phenylsulfonyl)butanamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(benzenesulfonyl)-N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-besyl-N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)butyramide Formula: C25H33N3O3S2 MolecularWeight: 487.67782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CCN(CC)CC)C(=O)CCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CCN(CC)CC)C(=O)CCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O3S2/c1-4-20-12-10-15-22-24(20)26-25(32-22)28(18-17-27(5-2)6-3)23(29)16-11-19-33(30,31)21-13-8-7-9-14-21/h7-10,12-15H,4-6,11,16-19H2,1-3H3