N',N'-dibutyl-N-(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)propane-1,3-diamine

Systemtic Name: N',N'-dibutyl-N-(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)propane-1,3-diamine Openeye Name: N',N'-dibutyl-N-(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)propane-1,3-diamine CAS Name: N',N'-dibutyl-N-(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)propane-1,3-diamine IUPAC Name: N',N'-dibutyl-N-(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)propane-1,3-diamine Traditional Name: dibutyl-[3-[(9-methoxy-5H-pyrimid[5,4-b]indol-4-yl)amino]propyl]amine Formula: C22H33N5O MolecularWeight: 383.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCNC1=NC=NC2=C1NC3=C2C(=CC=C3)OC

Isomeric SMILES

CCCCN(CCCC)CCCNC1=NC=NC2=C1NC3=C2C(=CC=C3)OC

InChI

InChI=1S/C22H33N5O/c1-4-6-13-27(14-7-5-2)15-9-12-23-22-21-20(24-16-25-22)19-17(26-21)10-8-11-18(19)28-3/h8,10-11,16,26H,4-7,9,12-15H2,1-3H3,(H,23,24,25)