(2R)-2-(7-chloranyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanylpropanenitrile

Systemtic Name: (2R)-2-(7-chloranyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanylpropanenitrile Openeye Name: (2R)-2-(7-chloro-4-oxo-3-pentyl-quinazolin-2-yl)sulfanylpropanenitrile CAS Name: (2R)-2-[(7-chloro-4-oxo-3-pentyl-2-quinazolinyl)thio]propanenitrile IUPAC Name: (2R)-2-(7-chloro-4-oxo-3-pentylquinazolin-2-yl)sulfanylpropanenitrile Traditional Name: (2R)-2-[(3-amyl-7-chloro-4-keto-quinazolin-2-yl)thio]propionitrile Formula: C16H18ClN3OS MolecularWeight: 335.85162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C#N

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1S[C@H](C)C#N

InChI

InChI=1S/C16H18ClN3OS/c1-3-4-5-8-20-15(21)13-7-6-12(17)9-14(13)19-16(20)22-11(2)10-18/h6-7,9,11H,3-5,8H2,1-2H3/t11-/m1/s1