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

Systemtic Name: N-[5-(2-azanyl-6-chloranyl-quinazolin-4-yl)-2-methyl-phenyl]-2-cyano-ethanamide Openeye Name: N-[5-(2-amino-6-chloro-quinazolin-4-yl)-2-methyl-phenyl]-2-cyano-acetamide CAS Name: N-[5-(2-amino-6-chloro-4-quinazolinyl)-2-methylphenyl]-2-cyanoacetamide IUPAC Name: N-[5-(2-amino-6-chloroquinazolin-4-yl)-2-methylphenyl]-2-cyanoacetamide Traditional Name: N-[5-(2-amino-6-chloro-quinazolin-4-yl)-2-methyl-phenyl]-2-cyano-acetamide Formula: C18H14ClN5O MolecularWeight: 351.78966

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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)CC#N

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClN5O/c1-10-2-3-11(8-15(10)22-16(25)6-7-20)17-13-9-12(19)4-5-14(13)23-18(21)24-17/h2-5,8-9H,6H2,1H3,(H,22,25)(H2,21,23,24)