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

Systemtic Name: 7-chloranyl-2-(5,6-dimethylpyridin-3-yl)-N,N,9-trimethyl-pyrimido[4,5-b]indole-4-carboxamide Openeye Name: 7-chloro-2-(5,6-dimethyl-3-pyridyl)-N,N,9-trimethyl-pyrimido[4,5-b]indole-4-carboxamide CAS Name: 7-chloro-2-(5,6-dimethyl-3-pyridinyl)-N,N,9-trimethyl-4-pyrimido[4,5-b]indolecarboxamide IUPAC Name: 7-chloro-2-(5,6-dimethylpyridin-3-yl)-N,N,9-trimethylpyrimido[4,5-b]indole-4-carboxamide Traditional Name: 7-chloro-2-(5,6-dimethyl-3-pyridyl)-N,N,9-trimethyl-pyrimid[4,5-b]indole-4-carboxamide Formula: C21H20ClN5O MolecularWeight: 393.8694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)C2=NC(=C3C4=C(C=C(C=C4)Cl)N(C3=N2)C)C(=O)N(C)C)C

Isomeric SMILES

CC1=C(N=CC(=C1)C2=NC(=C3C4=C(C=C(C=C4)Cl)N(C3=N2)C)C(=O)N(C)C)C

InChI

InChI=1S/C21H20ClN5O/c1-11-8-13(10-23-12(11)2)19-24-18(21(28)26(3)4)17-15-7-6-14(22)9-16(15)27(5)20(17)25-19/h6-10H,1-5H3