[5,6-bis(chloranyl)-2-(cyanoamino)-4H-quinazolin-3-yl] butanoate

Systemtic Name: [5,6-bis(chloranyl)-2-(cyanoamino)-4H-quinazolin-3-yl] butanoate Openeye Name: [5,6-dichloro-2-(cyanoamino)-4H-quinazolin-3-yl] butanoate CAS Name: butanoic acid [5,6-dichloro-2-(cyanoamino)-4H-quinazolin-3-yl] ester IUPAC Name: [5,6-dichloro-2-(cyanoamino)-4H-quinazolin-3-yl] butanoate Traditional Name: butyric acid [5,6-dichloro-2-(cyanoamino)-4H-quinazolin-3-yl] ester Formula: C13H12Cl2N4O2 MolecularWeight: 327.16598

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)ON1CC2=C(C=CC(=C2Cl)Cl)N=C1NC#N

Isomeric SMILES

CCCC(=O)ON1CC2=C(C=CC(=C2Cl)Cl)N=C1NC#N

InChI

InChI=1S/C13H12Cl2N4O2/c1-2-3-11(20)21-19-6-8-10(18-13(19)17-7-16)5-4-9(14)12(8)15/h4-5H,2-3,6H2,1H3,(H,17,18)