2-[2-[[2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-yl]amino]ethylsulfanyl]ethanol

Systemtic Name: 2-[2-[[2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-yl]amino]ethylsulfanyl]ethanol Openeye Name: 2-[2-[[2-[(E)-2-(3-pyridyl)vinyl]quinazolin-4-yl]amino]ethylsulfanyl]ethanol CAS Name: 2-[2-[[2-[(E)-2-(3-pyridinyl)ethenyl]-4-quinazolinyl]amino]ethylthio]ethanol IUPAC Name: 2-[2-[[2-[(E)-2-pyridin-3-ylethenyl]quinazolin-4-yl]amino]ethylsulfanyl]ethanol Traditional Name: 2-[2-[[2-[(E)-2-(3-pyridyl)vinyl]quinazolin-4-yl]amino]ethylthio]ethanol Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C=CC3=CN=CC=C3)NCCSCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)/C=C/C3=CN=CC=C3)NCCSCCO

InChI

InChI=1S/C19H20N4OS/c24-11-13-25-12-10-21-19-16-5-1-2-6-17(16)22-18(23-19)8-7-15-4-3-9-20-14-15/h1-9,14,24H,10-13H2,(H,21,22,23)/b8-7+