7-chloranyl-2-(6-ethoxypyridin-3-yl)-N,N,9-trimethyl-pyrimido[4,5-b]indole-4-carboxamide

Systemtic Name: 7-chloranyl-2-(6-ethoxypyridin-3-yl)-N,N,9-trimethyl-pyrimido[4,5-b]indole-4-carboxamide Openeye Name: 7-chloro-2-(6-ethoxy-3-pyridyl)-N,N,9-trimethyl-pyrimido[4,5-b]indole-4-carboxamide CAS Name: 7-chloro-2-(6-ethoxy-3-pyridinyl)-N,N,9-trimethyl-4-pyrimido[4,5-b]indolecarboxamide IUPAC Name: 7-chloro-2-(6-ethoxypyridin-3-yl)-N,N,9-trimethylpyrimido[4,5-b]indole-4-carboxamide Traditional Name: 7-chloro-2-(6-ethoxy-3-pyridyl)-N,N,9-trimethyl-pyrimid[4,5-b]indole-4-carboxamide Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=C(C=C1)C2=NC(=C3C4=C(C=C(C=C4)Cl)N(C3=N2)C)C(=O)N(C)C

Isomeric SMILES

CCOC1=NC=C(C=C1)C2=NC(=C3C4=C(C=C(C=C4)Cl)N(C3=N2)C)C(=O)N(C)C

InChI

InChI=1S/C21H20ClN5O2/c1-5-29-16-9-6-12(11-23-16)19-24-18(21(28)26(2)3)17-14-8-7-13(22)10-15(14)27(4)20(17)25-19/h6-11H,5H2,1-4H3