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

Systemtic Name: 1-chloranyl-6-iodanyl-5-methyl-8,11-bis(methylsulfanyl)-10H-pyrimido[4,5-b][1,4]benzodiazocine Openeye Name: 1-chloro-6-iodo-5-methyl-8,11-bis(methylsulfanyl)-10H-pyrimido[4,5-b][1,4]benzodiazocine CAS Name: 1-chloro-6-iodo-5-methyl-8,11-bis(methylthio)-10H-pyrimido[4,5-b][1,4]benzodiazocine IUPAC Name: 1-chloro-6-iodo-5-methyl-8,11-bis(methylsulfanyl)-10H-pyrimido[4,5-b][1,4]benzodiazocine Traditional Name: 1-chloro-6-iodo-5-methyl-8,11-bis(methylthio)-10H-pyrimido[4,5-b][1,4]benzodiazocine Formula: C15H14ClIN4S2 MolecularWeight: 476.78593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14ClIN4S2/c1-21-13-8(4-9(22-2)6-10(13)17)5-11(23-3)20-12-14(16)18-7-19-15(12)21/h4,6-7H,5H2,1-3H3