3-[7-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[7-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: 3-(7-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylpropanenitrile CAS Name: 3-[[7-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: 3-[7-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[(7-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]propionitrile Formula: C15H16ClN3OS MolecularWeight: 321.82504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCCC#N

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCCC#N

InChI

InChI=1S/C15H16ClN3OS/c1-10(2)9-19-14(20)12-5-4-11(16)8-13(12)18-15(19)21-7-3-6-17/h4-5,8,10H,3,7,9H2,1-2H3