5-[2-(2,5-dimethoxyphenyl)ethynyl]quinazoline-2,4-diamine

Systemtic Name: 5-[2-(2,5-dimethoxyphenyl)ethynyl]quinazoline-2,4-diamine Openeye Name: 5-[2-(2,5-dimethoxyphenyl)ethynyl]quinazoline-2,4-diamine CAS Name: 5-[2-(2,5-dimethoxyphenyl)ethynyl]quinazoline-2,4-diamine IUPAC Name: 5-[2-(2,5-dimethoxyphenyl)ethynyl]quinazoline-2,4-diamine Traditional Name: [2-amino-5-[2-(2,5-dimethoxyphenyl)ethynyl]quinazolin-4-yl]amine Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C#CC2=C3C(=CC=C2)N=C(N=C3N)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C#CC2=C3C(=CC=C2)N=C(N=C3N)N

InChI

InChI=1S/C18H16N4O2/c1-23-13-8-9-15(24-2)12(10-13)7-6-11-4-3-5-14-16(11)17(19)22-18(20)21-14/h3-5,8-10H,1-2H3,(H4,19,20,21,22)