3-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-(4-ethanoylphenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-(4-ethanoylphenyl)pyrrolidine-2,5-dione Openeye Name: 1-(4-acetylphenyl)-3-[1,3-benzothiazol-2-ylmethyl(methyl)amino]pyrrolidine-2,5-dione CAS Name: 1-(4-acetylphenyl)-3-[1,3-benzothiazol-2-ylmethyl(methyl)amino]pyrrolidine-2,5-dione IUPAC Name: 1-(4-acetylphenyl)-3-[1,3-benzothiazol-2-ylmethyl(methyl)amino]pyrrolidine-2,5-dione Traditional Name: 1-(4-acetylphenyl)-3-[1,3-benzothiazol-2-ylmethyl(methyl)amino]pyrrolidine-2,5-quinone Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3O3S/c1-13(25)14-7-9-15(10-8-14)24-20(26)11-17(21(24)27)23(2)12-19-22-16-5-3-4-6-18(16)28-19/h3-10,17H,11-12H2,1-2H3