6-bromanyl-1-chloranyl-8-(2-hydroxyphenyl)-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one

Systemtic Name: 6-bromanyl-1-chloranyl-8-(2-hydroxyphenyl)-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one Openeye Name: 6-bromo-1-chloro-8-(2-hydroxyphenyl)-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one CAS Name: 6-bromo-1-chloro-8-(2-hydroxyphenyl)-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one IUPAC Name: 6-bromo-1-chloro-8-(2-hydroxyphenyl)-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one Traditional Name: 6-bromo-1-chloro-8-(2-hydroxyphenyl)-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one Formula: C19H14BrClN4O2 MolecularWeight: 445.69706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(=O)NC3=C1N=CN=C3Cl)C=C(C=C2Br)C4=CC=CC=C4O

Isomeric SMILES

CN1C2=C(CC(=O)NC3=C1N=CN=C3Cl)C=C(C=C2Br)C4=CC=CC=C4O

InChI

InChI=1S/C19H14BrClN4O2/c1-25-17-11(8-15(27)24-16-18(21)22-9-23-19(16)25)6-10(7-13(17)20)12-4-2-3-5-14(12)26/h2-7,9,26H,8H2,1H3,(H,24,27)