N-(3-bromophenyl)-9-(2-diethylaminoethyl)-6-methoxy-pyrimido[4,5-b]indol-4-amine

Systemtic Name: N-(3-bromophenyl)-9-(2-diethylaminoethyl)-6-methoxy-pyrimido[4,5-b]indol-4-amine Openeye Name: N-(3-bromophenyl)-9-(2-diethylaminoethyl)-6-methoxy-pyrimido[4,5-b]indol-4-amine CAS Name: N-(3-bromophenyl)-9-(2-diethylaminoethyl)-6-methoxy-4-pyrimido[4,5-b]indolamine IUPAC Name: N-(3-bromophenyl)-9-(2-diethylaminoethyl)-6-methoxypyrimido[4,5-b]indol-4-amine Traditional Name: 2-[4-(3-bromoanilino)-6-methoxy-pyrimid[4,5-b]indol-9-yl]ethyl-diethyl-amine Formula: C23H26BrN5O MolecularWeight: 468.38944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=C(C=C(C=C2)OC)C3=C1N=CN=C3NC4=CC(=CC=C4)Br

Isomeric SMILES

CCN(CC)CCN1C2=C(C=C(C=C2)OC)C3=C1N=CN=C3NC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H26BrN5O/c1-4-28(5-2)11-12-29-20-10-9-18(30-3)14-19(20)21-22(25-15-26-23(21)29)27-17-8-6-7-16(24)13-17/h6-10,13-15H,4-5,11-12H2,1-3H3,(H,25,26,27)