6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2-methoxyphenyl)carbamothioyl]hexanamide

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2-methoxyphenyl)carbamothioyl]hexanamide Openeye Name: 6-(1,3-dioxoisoindolin-2-yl)-N-[(2-methoxyphenyl)carbamothioyl]hexanamide CAS Name: 6-(1,3-dioxo-2-isoindolyl)-N-[(2-methoxyanilino)-sulfanylidenemethyl]hexanamide IUPAC Name: 6-(1,3-dioxoisoindol-2-yl)-N-[(2-methoxyphenyl)carbamothioyl]hexanamide Traditional Name: N-[(2-methoxyphenyl)thiocarbamoyl]-6-phthalimido-hexanamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H23N3O4S/c1-29-18-12-7-6-11-17(18)23-22(30)24-19(26)13-3-2-8-14-25-20(27)15-9-4-5-10-16(15)21(25)28/h4-7,9-12H,2-3,8,13-14H2,1H3,(H2,23,24,26,30)