8-bromanyl-1-chloranyl-5-methyl-6,11-bis(methylsulfanyl)-10H-pyrimido[4,5-b][1,4]benzodiazocine

Systemtic Name: 8-bromanyl-1-chloranyl-5-methyl-6,11-bis(methylsulfanyl)-10H-pyrimido[4,5-b][1,4]benzodiazocine Openeye Name: 8-bromo-1-chloro-5-methyl-6,11-bis(methylsulfanyl)-10H-pyrimido[4,5-b][1,4]benzodiazocine CAS Name: 8-bromo-1-chloro-5-methyl-6,11-bis(methylthio)-10H-pyrimido[4,5-b][1,4]benzodiazocine IUPAC Name: 8-bromo-1-chloro-5-methyl-6,11-bis(methylsulfanyl)-10H-pyrimido[4,5-b][1,4]benzodiazocine Traditional Name: 8-bromo-1-chloro-5-methyl-6,11-bis(methylthio)-10H-pyrimido[4,5-b][1,4]benzodiazocine Formula: C15H14BrClN4S2 MolecularWeight: 429.78546

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2CC(=NC3=C1N=CN=C3Cl)SC)Br)SC

Isomeric SMILES

CN1C2=C(C=C(C=C2CC(=NC3=C1N=CN=C3Cl)SC)Br)SC

InChI

InChI=1S/C15H14BrClN4S2/c1-21-13-8(4-9(16)6-10(13)22-2)5-11(23-3)20-12-14(17)18-7-19-15(12)21/h4,6-7H,5H2,1-3H3