4-chloranyl-4-methyl-N-[[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbamothioyl]pentanamide

Systemtic Name: 4-chloranyl-4-methyl-N-[[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbamothioyl]pentanamide Openeye Name: 4-chloro-4-methyl-N-[(2-methyl-1,3-dioxo-isoindolin-5-yl)carbamothioyl]pentanamide CAS Name: 4-chloro-4-methyl-N-[[(2-methyl-1,3-dioxo-5-isoindolyl)amino]-sulfanylidenemethyl]pentanamide IUPAC Name: 4-chloro-4-methyl-N-[(2-methyl-1,3-dioxoisoindol-5-yl)carbamothioyl]pentanamide Traditional Name: 4-chloro-N-[(1,3-diketo-2-methyl-isoindolin-5-yl)thiocarbamoyl]-4-methyl-valeramide Formula: C16H18ClN3O3S MolecularWeight: 367.85042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=O)NC(=S)NC1=CC2=C(C=C1)C(=O)N(C2=O)C)Cl

Isomeric SMILES

CC(C)(CCC(=O)NC(=S)NC1=CC2=C(C=C1)C(=O)N(C2=O)C)Cl

InChI

InChI=1S/C16H18ClN3O3S/c1-16(2,17)7-6-12(21)19-15(24)18-9-4-5-10-11(8-9)14(23)20(3)13(10)22/h4-5,8H,6-7H2,1-3H3,(H2,18,19,21,24)