5-[(3-chloranyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(3-chloranyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(4-benzyloxy-3-chloro-5-methoxy-phenyl)methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-chloro-5-methoxy-4-phenylmethoxyphenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-chloro-5-methoxy-4-phenylmethoxyphenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(4-benzoxy-3-chloro-5-methoxy-benzylidene)-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C31H23ClN2O4S MolecularWeight: 555.04332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Cl)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Cl)OCC5=CC=CC=C5

InChI

InChI=1S/C31H23ClN2O4S/c1-37-27-19-22(18-26(32)28(27)38-20-21-11-5-2-6-12-21)17-25-29(35)33(23-13-7-3-8-14-23)31(39)34(30(25)36)24-15-9-4-10-16-24/h2-19H,20H2,1H3