N',N'-diethyl-N-(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)ethane-1,2-diamine

Systemtic Name: N',N'-diethyl-N-(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)ethane-1,2-diamine Openeye Name: N',N'-diethyl-N-(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)ethane-1,2-diamine CAS Name: N',N'-diethyl-N-(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)ethane-1,2-diamine IUPAC Name: N',N'-diethyl-N-(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)ethane-1,2-diamine Traditional Name: diethyl-[2-[(8-fluoro-5H-pyrimid[5,4-b]indol-4-yl)amino]ethyl]amine Formula: C16H20FN5 MolecularWeight: 301.361903

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC=NC2=C1NC3=C2C=C(C=C3)F

Isomeric SMILES

CCN(CC)CCNC1=NC=NC2=C1NC3=C2C=C(C=C3)F

InChI

InChI=1S/C16H20FN5/c1-3-22(4-2)8-7-18-16-15-14(19-10-20-16)12-9-11(17)5-6-13(12)21-15/h5-6,9-10,21H,3-4,7-8H2,1-2H3,(H,18,19,20)