N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methoxy-phenyl]carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methoxy-phenyl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[[4-(1,3-dioxoisoindolin-2-yl)-3-methoxy-phenyl]carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[4-(1,3-dioxo-2-isoindolyl)-3-methoxyanilino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[[4-(1,3-dioxoisoindol-2-yl)-3-methoxyphenyl]carbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[(3-methoxy-4-phthalimido-phenyl)thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C21H21N3O4S/c1-21(2,3)19(27)23-20(29)22-12-9-10-15(16(11-12)28-4)24-17(25)13-7-5-6-8-14(13)18(24)26/h5-11H,1-4H3,(H2,22,23,27,29)