2-(benzenecarbonothioylamino)-N-[1,3-bis(oxidanylidene)isoindol-2-yl]-4,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: 2-(benzenecarbonothioylamino)-N-[1,3-bis(oxidanylidene)isoindol-2-yl]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-(benzenecarbonothioylamino)-N-(1,3-dioxoisoindolin-2-yl)-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-(benzenecarbonothioylamino)-N-(1,3-dioxo-2-isoindolyl)-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-(benzenecarbonothioylamino)-N-(1,3-dioxoisoindol-2-yl)-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-(benzenecarbonothioylamino)-4,5-dimethyl-N-phthalimido-thiophene-3-carboxamide Formula: C22H17N3O3S2 MolecularWeight: 435.51868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NN2C(=O)C3=CC=CC=C3C2=O)NC(=S)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NN2C(=O)C3=CC=CC=C3C2=O)NC(=S)C4=CC=CC=C4)C

InChI

InChI=1S/C22H17N3O3S2/c1-12-13(2)30-20(23-19(29)14-8-4-3-5-9-14)17(12)18(26)24-25-21(27)15-10-6-7-11-16(15)22(25)28/h3-11H,1-2H3,(H,23,29)(H,24,26)