2-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]guanidine

Systemtic Name: 2-[4-[(3-ethynylphenyl)amino]quinazolin-6-yl]guanidine Openeye Name: 2-[4-(3-ethynylanilino)quinazolin-6-yl]guanidine CAS Name: 2-[4-(3-ethynylanilino)-6-quinazolinyl]guanidine IUPAC Name: 2-[4-(3-ethynylanilino)quinazolin-6-yl]guanidine Traditional Name: 2-[4-(3-ethynylanilino)quinazolin-6-yl]guanidine Formula: C17H14N6 MolecularWeight: 302.33326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N6/c1-2-11-4-3-5-12(8-11)22-16-14-9-13(23-17(18)19)6-7-15(14)20-10-21-16/h1,3-10H,(H4,18,19,23)(H,20,21,22)