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

Systemtic Name: N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-chloranyl-phenyl]carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[[2-chloro-4-(1,3-dioxoisoindolin-2-yl)phenyl]carbamothioyl]-4-phenyl-benzamide CAS Name: N-[[2-chloro-4-(1,3-dioxo-2-isoindolyl)anilino]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[[2-chloro-4-(1,3-dioxoisoindol-2-yl)phenyl]carbamothioyl]-4-phenylbenzamide Traditional Name: N-[(2-chloro-4-phthalimido-phenyl)thiocarbamoyl]-4-phenyl-benzamide Formula: C28H18ClN3O3S MolecularWeight: 511.97882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NC3=C(C=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NC3=C(C=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O)Cl

InChI

InChI=1S/C28H18ClN3O3S/c29-23-16-20(32-26(34)21-8-4-5-9-22(21)27(32)35)14-15-24(23)30-28(36)31-25(33)19-12-10-18(11-13-19)17-6-2-1-3-7-17/h1-16H,(H2,30,31,33,36)