N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-ethanoyl-benzenesulfonamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-ethanoyl-benzenesulfonamide Openeye Name: 3-acetyl-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]benzenesulfonamide CAS Name: 3-acetyl-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]benzenesulfonamide IUPAC Name: 3-acetyl-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]benzenesulfonamide Traditional Name: 3-acetyl-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]benzenesulfonamide Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H18N2O3S2/c1-15(25)17-5-4-6-19(14-17)29(26,27)24-18-11-9-16(10-12-18)13-22-23-20-7-2-3-8-21(20)28-22/h2-12,14,24H,13H2,1H3