4-azanyl-9-(3-methylphenyl)-N-naphthalen-1-yl-pyrimido[4,5-b]indole-2-carboxamide

Systemtic Name: 4-azanyl-9-(3-methylphenyl)-N-naphthalen-1-yl-pyrimido[4,5-b]indole-2-carboxamide Openeye Name: 4-amino-9-(m-tolyl)-N-(1-naphthyl)pyrimido[4,5-b]indole-2-carboxamide CAS Name: 4-amino-9-(3-methylphenyl)-N-(1-naphthalenyl)-2-pyrimido[4,5-b]indolecarboxamide IUPAC Name: 4-amino-9-(3-methylphenyl)-N-naphthalen-1-ylpyrimido[4,5-b]indole-2-carboxamide Traditional Name: 4-amino-9-(m-tolyl)-N-(1-naphthyl)pyrimid[4,5-b]indole-2-carboxamide Formula: C28H21N5O MolecularWeight: 443.49924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=CC=CC=C3C4=C2N=C(N=C4N)C(=O)NC5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=CC=CC=C3C4=C2N=C(N=C4N)C(=O)NC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C28H21N5O/c1-17-8-6-11-19(16-17)33-23-15-5-4-13-21(23)24-25(29)31-26(32-27(24)33)28(34)30-22-14-7-10-18-9-2-3-12-20(18)22/h2-16H,1H3,(H,30,34)(H2,29,31,32)