5-[[3-bromanyl-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[3-bromanyl-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[3-bromo-5-methoxy-4-(o-tolylmethoxy)phenyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[3-bromo-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[3-bromo-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[3-bromo-5-methoxy-4-(2-methylbenzyl)oxy-benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H17BrN2O4S MolecularWeight: 461.32898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC2=C(C=C(C=C2Br)C=C3C(=O)NC(=S)NC3=O)OC

Isomeric SMILES

CC1=CC=CC=C1COC2=C(C=C(C=C2Br)C=C3C(=O)NC(=S)NC3=O)OC

InChI

InChI=1S/C20H17BrN2O4S/c1-11-5-3-4-6-13(11)10-27-17-15(21)8-12(9-16(17)26-2)7-14-18(24)22-20(28)23-19(14)25/h3-9H,10H2,1-2H3,(H2,22,23,24,25,28)