4-chloranyl-11-methyl-6-propyl-pyrimido[4,5-b][1,4]benzodiazepine

Systemtic Name: 4-chloranyl-11-methyl-6-propyl-pyrimido[4,5-b][1,4]benzodiazepine Openeye Name: 4-chloro-11-methyl-6-propyl-pyrimido[4,5-b][1,4]benzodiazepine CAS Name: 4-chloro-11-methyl-6-propylpyrimido[4,5-b][1,4]benzodiazepine IUPAC Name: 4-chloro-11-methyl-6-propylpyrimido[4,5-b][1,4]benzodiazepine Traditional Name: 4-chloro-11-methyl-6-propyl-pyrimido[4,5-b][1,4]benzodiazepine Formula: C15H15ClN4 MolecularWeight: 286.7594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N=CN=C2Cl)N(C3=CC=CC=C31)C

Isomeric SMILES

CCCC1=NC2=C(N=CN=C2Cl)N(C3=CC=CC=C31)C

InChI

InChI=1S/C15H15ClN4/c1-3-6-11-10-7-4-5-8-12(10)20(2)15-13(19-11)14(16)17-9-18-15/h4-5,7-9H,3,6H2,1-2H3