N-(3-ethynylphenyl)-7-propylsulfanyl-quinazolin-4-amine

Systemtic Name: N-(3-ethynylphenyl)-7-propylsulfanyl-quinazolin-4-amine Openeye Name: N-(3-ethynylphenyl)-7-propylsulfanyl-quinazolin-4-amine CAS Name: N-(3-ethynylphenyl)-7-(propylthio)-4-quinazolinamine IUPAC Name: N-(3-ethynylphenyl)-7-propylsulfanylquinazolin-4-amine Traditional Name: (3-ethynylphenyl)-[7-(propylthio)quinazolin-4-yl]amine Formula: C19H17N3S MolecularWeight: 319.42338

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC2=C(C=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CCCSC1=CC2=C(C=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C19H17N3S/c1-3-10-23-16-8-9-17-18(12-16)20-13-21-19(17)22-15-7-5-6-14(4-2)11-15/h2,5-9,11-13H,3,10H2,1H3,(H,20,21,22)