N-(2-diethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfonyl-butanamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfonyl-butanamide Openeye Name: N-(2-diethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(p-tolylsulfonyl)butanamide CAS Name: N-(2-diethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfonylbutanamide IUPAC Name: N-(2-diethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfonylbutanamide Traditional Name: N-(2-diethylaminoethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-tosyl-butyramide Formula: C25H33N3O3S2 MolecularWeight: 487.67782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)CCCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)CCCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H33N3O3S2/c1-5-27(6-2)15-16-28(25-26-22-14-11-20(4)18-23(22)32-25)24(29)8-7-17-33(30,31)21-12-9-19(3)10-13-21/h9-14,18H,5-8,15-17H2,1-4H3