(5S)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)-oxidanyl-methylidene]-5-pyridin-4-yl-pyrrolidine-2,3-dione

Systemtic Name: (5S)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)-oxidanyl-methylidene]-5-pyridin-4-yl-pyrrolidine-2,3-dione Openeye Name: (5S)-4-[hydroxy(p-tolyl)methylene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-pyridyl)pyrrolidine-2,3-dione CAS Name: (5S)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-pyridin-4-ylpyrrolidine-2,3-dione IUPAC Name: (5S)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-pyridin-4-ylpyrrolidine-2,3-dione Traditional Name: (5S)-4-[hydroxy(p-tolyl)methylene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-pyridyl)pyrrolidine-2,3-quinone Formula: C25H19N3O3S MolecularWeight: 441.50166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)C)C5=CC=NC=C5)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=C2[C@@H](N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)C)C5=CC=NC=C5)O

InChI

InChI=1S/C25H19N3O3S/c1-14-3-6-17(7-4-14)22(29)20-21(16-9-11-26-12-10-16)28(24(31)23(20)30)25-27-18-8-5-15(2)13-19(18)32-25/h3-13,21,29H,1-2H3/t21-/m0/s1