N-[(3,5-dimethoxyphenyl)methyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-amine CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (3,5-dimethoxybenzyl)-(7-methoxy-5H-pyrimid[5,4-b]indol-4-yl)amine Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(N2)C(=NC=N3)NCC4=CC(=CC(=C4)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(N2)C(=NC=N3)NCC4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C20H20N4O3/c1-25-13-4-5-16-17(9-13)24-19-18(16)22-11-23-20(19)21-10-12-6-14(26-2)8-15(7-12)27-3/h4-9,11,24H,10H2,1-3H3,(H,21,22,23)