1-(2-chlorophenyl)-5-[(1-ethylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(2-chlorophenyl)-5-[(1-ethylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(2-chlorophenyl)-5-[(1-ethylindol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(2-chlorophenyl)-5-[(1-ethyl-3-indolyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(2-chlorophenyl)-5-[(1-ethylindol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(2-chlorophenyl)-5-[(1-ethylindol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4Cl

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H16ClN3O2S/c1-2-24-12-13(14-7-3-5-9-17(14)24)11-15-19(26)23-21(28)25(20(15)27)18-10-6-4-8-16(18)22/h3-12H,2H2,1H3,(H,23,26,28)