2-butyl-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-[4-(4-chlorophenyl)thiazol-2-yl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[4-(4-chlorophenyl)-2-thiazolyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-N-[4-(4-chlorophenyl)thiazol-2-yl]-1,3-diketo-isoindoline-5-carboxamide Formula: C22H18ClN3O3S MolecularWeight: 439.91462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3O3S/c1-2-3-10-26-20(28)16-9-6-14(11-17(16)21(26)29)19(27)25-22-24-18(12-30-22)13-4-7-15(23)8-5-13/h4-9,11-12H,2-3,10H2,1H3,(H,24,25,27)