N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(phenylsulfonylamino)propanamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(phenylsulfonylamino)propanamide Openeye Name: 3-(benzenesulfonamido)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide CAS Name: 3-(benzenesulfonamido)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide IUPAC Name: 3-(benzenesulfonamido)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide Traditional Name: 3-(benzenesulfonamido)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propionamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCNS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCNS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O3S2/c1-16-7-12-20-21(15-16)30-23(26-20)17-8-10-18(11-9-17)25-22(27)13-14-24-31(28,29)19-5-3-2-4-6-19/h2-12,15,24H,13-14H2,1H3,(H,25,27)