1,3-bis[[2-(chloromethyl)phenyl]carbonyl]-2,4-dihydroquinazoline-2,4-dicarbonitrile

Systemtic Name: 1,3-bis[[2-(chloromethyl)phenyl]carbonyl]-2,4-dihydroquinazoline-2,4-dicarbonitrile Openeye Name: 1,3-bis[2-(chloromethyl)benzoyl]-2,4-dihydroquinazoline-2,4-dicarbonitrile CAS Name: 1,3-bis[[2-(chloromethyl)phenyl]-oxomethyl]-2,4-dihydroquinazoline-2,4-dicarbonitrile IUPAC Name: 1,3-bis[2-(chloromethyl)benzoyl]-2,4-dihydroquinazoline-2,4-dicarbonitrile Traditional Name: 1,3-bis[2-(chloromethyl)benzoyl]-2,4-dihydroquinazoline-2,4-dicarbonitrile Formula: C26H18Cl2N4O2 MolecularWeight: 489.35272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCl)C(=O)N2C(C3=CC=CC=C3N(C2C#N)C(=O)C4=CC=CC=C4CCl)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CCl)C(=O)N2C(C3=CC=CC=C3N(C2C#N)C(=O)C4=CC=CC=C4CCl)C#N

InChI

InChI=1S/C26H18Cl2N4O2/c27-13-17-7-1-3-9-19(17)25(33)31-22-12-6-5-11-21(22)23(15-29)32(24(31)16-30)26(34)20-10-4-2-8-18(20)14-28/h1-12,23-24H,13-14H2