N-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-4-yl]carbamothioyl]-5-chloranyl-naphthalene-1-carboxamide

Systemtic Name: N-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-4-yl]carbamothioyl]-5-chloranyl-naphthalene-1-carboxamide Openeye Name: 5-chloro-N-[(1,3-dioxo-2-phenyl-isoindolin-4-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-chloro-N-[[(1,3-dioxo-2-phenyl-4-isoindolyl)amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-chloro-N-[(1,3-dioxo-2-phenylisoindol-4-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-chloro-N-[(1,3-diketo-2-phenyl-isoindolin-4-yl)thiocarbamoyl]-1-naphthamide Formula: C26H16ClN3O3S MolecularWeight: 485.94154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Cl

InChI

InChI=1S/C26H16ClN3O3S/c27-20-13-5-9-16-17(20)10-4-11-18(16)23(31)29-26(34)28-21-14-6-12-19-22(21)25(33)30(24(19)32)15-7-2-1-3-8-15/h1-14H,(H2,28,29,31,34)