N-[5-(2-azanyl-6-chloranyl-quinazolin-4-yl)-2-methyl-phenyl]pyridine-4-carboxamide

Systemtic Name: N-[5-(2-azanyl-6-chloranyl-quinazolin-4-yl)-2-methyl-phenyl]pyridine-4-carboxamide Openeye Name: N-[5-(2-amino-6-chloro-quinazolin-4-yl)-2-methyl-phenyl]pyridine-4-carboxamide CAS Name: N-[5-(2-amino-6-chloro-4-quinazolinyl)-2-methylphenyl]-4-pyridinecarboxamide IUPAC Name: N-[5-(2-amino-6-chloroquinazolin-4-yl)-2-methylphenyl]pyridine-4-carboxamide Traditional Name: N-[5-(2-amino-6-chloro-quinazolin-4-yl)-2-methyl-phenyl]isonicotinamide Formula: C21H16ClN5O MolecularWeight: 389.83764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)N)NC(=O)C4=CC=NC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)N)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C21H16ClN5O/c1-12-2-3-14(10-18(12)25-20(28)13-6-8-24-9-7-13)19-16-11-15(22)4-5-17(16)26-21(23)27-19/h2-11H,1H3,(H,25,28)(H2,23,26,27)