4-azanyl-9-(4-chlorophenyl)-N-naphthalen-1-yl-pyrimido[4,5-b]indole-2-carboxamide

Systemtic Name: 4-azanyl-9-(4-chlorophenyl)-N-naphthalen-1-yl-pyrimido[4,5-b]indole-2-carboxamide Openeye Name: 4-amino-9-(4-chlorophenyl)-N-(1-naphthyl)pyrimido[4,5-b]indole-2-carboxamide CAS Name: 4-amino-9-(4-chlorophenyl)-N-(1-naphthalenyl)-2-pyrimido[4,5-b]indolecarboxamide IUPAC Name: 4-amino-9-(4-chlorophenyl)-N-naphthalen-1-ylpyrimido[4,5-b]indole-2-carboxamide Traditional Name: 4-amino-9-(4-chlorophenyl)-N-(1-naphthyl)pyrimid[4,5-b]indole-2-carboxamide Formula: C27H18ClN5O MolecularWeight: 463.91772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=NC4=C(C5=CC=CC=C5N4C6=CC=C(C=C6)Cl)C(=N3)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=NC4=C(C5=CC=CC=C5N4C6=CC=C(C=C6)Cl)C(=N3)N

InChI

InChI=1S/C27H18ClN5O/c28-17-12-14-18(15-13-17)33-22-11-4-3-9-20(22)23-24(29)31-25(32-26(23)33)27(34)30-21-10-5-7-16-6-1-2-8-19(16)21/h1-15H,(H,30,34)(H2,29,31,32)