N-benzo[e][1,3]benzothiazol-2-yl-4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanamide Openeye Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-benzo[e][1,3]benzothiazol-2-yl-butanamide CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-(2-benzo[e][1,3]benzothiazolyl)butanamide IUPAC Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-benzo[e][1,3]benzothiazol-2-ylbutanamide Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-benzo[e][1,3]benzothiazol-2-yl-butyramide Formula: C24H23N3O4S2 MolecularWeight: 481.58712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

InChI

InChI=1S/C24H23N3O4S2/c1-16(28)17-9-12-19(13-10-17)33(30,31)27(2)15-5-8-22(29)25-24-26-23-20-7-4-3-6-18(20)11-14-21(23)32-24/h3-4,6-7,9-14H,5,8,15H2,1-2H3,(H,25,26,29)