(7-chloranyl-9-methyl-2-phenyl-pyrimido[4,5-b]indol-4-yl)-piperidin-1-yl-methanone

Systemtic Name: (7-chloranyl-9-methyl-2-phenyl-pyrimido[4,5-b]indol-4-yl)-piperidin-1-yl-methanone Openeye Name: (7-chloro-9-methyl-2-phenyl-pyrimido[4,5-b]indol-4-yl)-(1-piperidyl)methanone CAS Name: (7-chloro-9-methyl-2-phenyl-4-pyrimido[4,5-b]indolyl)-(1-piperidinyl)methanone IUPAC Name: (7-chloro-9-methyl-2-phenylpyrimido[4,5-b]indol-4-yl)-piperidin-1-ylmethanone Traditional Name: (7-chloro-9-methyl-2-phenyl-pyrimid[4,5-b]indol-4-yl)-piperidino-methanone Formula: C23H21ClN4O MolecularWeight: 404.89204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)Cl)C3=C(N=C(N=C31)C4=CC=CC=C4)C(=O)N5CCCCC5

Isomeric SMILES

CN1C2=C(C=CC(=C2)Cl)C3=C(N=C(N=C31)C4=CC=CC=C4)C(=O)N5CCCCC5

InChI

InChI=1S/C23H21ClN4O/c1-27-18-14-16(24)10-11-17(18)19-20(23(29)28-12-6-3-7-13-28)25-21(26-22(19)27)15-8-4-2-5-9-15/h2,4-5,8-11,14H,3,6-7,12-13H2,1H3