methyl 2-[2-(3-cyanopropylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(3-cyanopropylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-(3-cyanopropylsulfanyl)-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-(3-cyanopropylthio)-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3-cyanopropylsulfanyl)-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-(3-cyanopropylthio)-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCCCC#N

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCCCC#N

InChI

InChI=1S/C15H15N3O3S/c1-21-13(19)10-18-14(20)11-6-2-3-7-12(11)17-15(18)22-9-5-4-8-16/h2-3,6-7H,4-5,9-10H2,1H3