2-azanyl-3-(2-chlorophenyl)-4-oxidanylidene-5-(quinazolin-2-ylmethyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-3-(2-chlorophenyl)-4-oxidanylidene-5-(quinazolin-2-ylmethyl)pyridine-3-carbonitrile Openeye Name: 2-amino-3-(2-chlorophenyl)-4-oxo-5-(quinazolin-2-ylmethyl)pyridine-3-carbonitrile CAS Name: 2-amino-3-(2-chlorophenyl)-4-oxo-5-(2-quinazolinylmethyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-3-(2-chlorophenyl)-4-oxo-5-(quinazolin-2-ylmethyl)pyridine-3-carbonitrile Traditional Name: 2-amino-3-(2-chlorophenyl)-4-keto-5-(quinazolin-2-ylmethyl)nicotinonitrile Formula: C21H14ClN5O MolecularWeight: 387.82176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC(=N2)CC3=CN=C(C(C3=O)(C#N)C4=CC=CC=C4Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C=NC(=N2)CC3=CN=C(C(C3=O)(C#N)C4=CC=CC=C4Cl)N

InChI

InChI=1S/C21H14ClN5O/c22-16-7-3-2-6-15(16)21(12-23)19(28)14(11-26-20(21)24)9-18-25-10-13-5-1-4-8-17(13)27-18/h1-8,10-11H,9H2,(H2,24,26)