7-chloranyl-4-[(3-ethynylphenyl)amino]quinazoline-6-carbonitrile

Systemtic Name: 7-chloranyl-4-[(3-ethynylphenyl)amino]quinazoline-6-carbonitrile Openeye Name: 7-chloro-4-(3-ethynylanilino)quinazoline-6-carbonitrile CAS Name: 7-chloro-4-(3-ethynylanilino)-6-quinazolinecarbonitrile IUPAC Name: 7-chloro-4-(3-ethynylanilino)quinazoline-6-carbonitrile Traditional Name: 7-chloro-4-(3-ethynylanilino)quinazoline-6-carbonitrile Formula: C17H9ClN4 MolecularWeight: 304.73316

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C(=C3)Cl)C#N

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C(=C3)Cl)C#N

InChI

InChI=1S/C17H9ClN4/c1-2-11-4-3-5-13(6-11)22-17-14-7-12(9-19)15(18)8-16(14)20-10-21-17/h1,3-8,10H,(H,20,21,22)