5-(4-tert-butylphenyl)-1-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-(5-methylfuran-2-yl)carbonyl-pyrrolidine-2,3-dione

Systemtic Name: 5-(4-tert-butylphenyl)-1-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-(5-methylfuran-2-yl)carbonyl-pyrrolidine-2,3-dione Openeye Name: 5-(4-tert-butylphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-(5-methylfuran-2-carbonyl)pyrrolidine-2,3-dione CAS Name: 5-(4-tert-butylphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[(5-methyl-2-furanyl)-oxomethyl]pyrrolidine-2,3-dione IUPAC Name: 5-(4-tert-butylphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-(5-methylfuran-2-carbonyl)pyrrolidine-2,3-dione Traditional Name: 5-(4-tert-butylphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-(5-methyl-2-furoyl)pyrrolidine-2,3-quinone Formula: C27H23FN2O4S MolecularWeight: 490.545923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=O)C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)F)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC1=CC=C(O1)C(=O)C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)F)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C27H23FN2O4S/c1-14-5-12-19(34-14)23(31)21-22(15-6-8-16(9-7-15)27(2,3)4)30(25(33)24(21)32)26-29-18-11-10-17(28)13-20(18)35-26/h5-13,21-22H,1-4H3