(2R)-2-[6-bromanyl-4-oxidanylidene-3-[(1R)-1-phenylethyl]quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: (2R)-2-[6-bromanyl-4-oxidanylidene-3-[(1R)-1-phenylethyl]quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: (2R)-2-[6-bromo-4-oxo-3-[(1R)-1-phenylethyl]quinazolin-2-yl]sulfanylpropanenitrile CAS Name: (2R)-2-[[6-bromo-4-oxo-3-[(1R)-1-phenylethyl]-2-quinazolinyl]thio]propanenitrile IUPAC Name: (2R)-2-[6-bromo-4-oxo-3-[(1R)-1-phenylethyl]quinazolin-2-yl]sulfanylpropanenitrile Traditional Name: (2R)-2-[[6-bromo-4-keto-3-[(1R)-1-phenylethyl]quinazolin-2-yl]thio]propionitrile Formula: C19H16BrN3OS MolecularWeight: 414.31884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC2=C(C=C(C=C2)Br)C(=O)N1C(C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C#N)SC1=NC2=C(C=C(C=C2)Br)C(=O)N1[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C19H16BrN3OS/c1-12(11-21)25-19-22-17-9-8-15(20)10-16(17)18(24)23(19)13(2)14-6-4-3-5-7-14/h3-10,12-13H,1-2H3/t12-,13-/m1/s1