N-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: N-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: N-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)-5H-pyrimido[5,4-b]indol-4-amine CAS Name: N-(3,4-dimethoxyphenyl)-N-(2-furanylmethyl)-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: N-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (3,4-dimethoxyphenyl)-(2-furfuryl)-(5H-pyrimid[5,4-b]indol-4-yl)amine Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CC=CO2)C3=NC=NC4=C3NC5=CC=CC=C54)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CC=CO2)C3=NC=NC4=C3NC5=CC=CC=C54)OC

InChI

InChI=1S/C23H20N4O3/c1-28-19-10-9-15(12-20(19)29-2)27(13-16-6-5-11-30-16)23-22-21(24-14-25-23)17-7-3-4-8-18(17)26-22/h3-12,14,26H,13H2,1-2H3