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

Systemtic Name: (2R)-2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: (2R)-2-[6-bromo-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanylpropanenitrile CAS Name: (2R)-2-[[6-bromo-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: (2R)-2-[6-bromo-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: (2R)-2-[[6-bromo-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]propionitrile Formula: C14H14BrN3O2S MolecularWeight: 368.24886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC2=C(C=C(C=C2)Br)C(=O)N1CCOC

Isomeric SMILES

C[C@H](C#N)SC1=NC2=C(C=C(C=C2)Br)C(=O)N1CCOC

InChI

InChI=1S/C14H14BrN3O2S/c1-9(8-16)21-14-17-12-4-3-10(15)7-11(12)13(19)18(14)5-6-20-2/h3-4,7,9H,5-6H2,1-2H3/t9-/m1/s1