N-(3-ethynylphenyl)-6-(4-methylsulfanylphenyl)quinazolin-4-amine

Systemtic Name: N-(3-ethynylphenyl)-6-(4-methylsulfanylphenyl)quinazolin-4-amine Openeye Name: N-(3-ethynylphenyl)-6-(4-methylsulfanylphenyl)quinazolin-4-amine CAS Name: N-(3-ethynylphenyl)-6-[4-(methylthio)phenyl]-4-quinazolinamine IUPAC Name: N-(3-ethynylphenyl)-6-(4-methylsulfanylphenyl)quinazolin-4-amine Traditional Name: (3-ethynylphenyl)-[6-[4-(methylthio)phenyl]quinazolin-4-yl]amine Formula: C23H17N3S MolecularWeight: 367.46618

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C#C

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC3=C(C=C2)N=CN=C3NC4=CC=CC(=C4)C#C

InChI

InChI=1S/C23H17N3S/c1-3-16-5-4-6-19(13-16)26-23-21-14-18(9-12-22(21)24-15-25-23)17-7-10-20(27-2)11-8-17/h1,4-15H,2H3,(H,24,25,26)