(2-phenyl-1,3-thiazol-4-yl)methyl 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-butyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-butyl-1,3-dioxo-5-isoindolecarboxylic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-butyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-butyl-1,3-diketo-isoindoline-5-carboxylic acid (2-phenylthiazol-4-yl)methyl ester Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O4S/c1-2-3-11-25-21(26)18-10-9-16(12-19(18)22(25)27)23(28)29-13-17-14-30-20(24-17)15-7-5-4-6-8-15/h4-10,12,14H,2-3,11,13H2,1H3