methyl 3-[4-oxidanylidene-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[4-oxo-2-[(1S)-2-oxocyclohexyl]sulfanyl-quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-[[(1S)-2-oxocyclohexyl]thio]-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-[(1S)-2-oxocyclohexyl]sulfanylquinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-[[(1S)-2-ketocyclohexyl]thio]quinazolin-3-yl]propionic acid methyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SC3CCCCC3=O

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1S[C@H]3CCCCC3=O

InChI

InChI=1S/C18H20N2O4S/c1-24-16(22)10-11-20-17(23)12-6-2-3-7-13(12)19-18(20)25-15-9-5-4-8-14(15)21/h2-3,6-7,15H,4-5,8-11H2,1H3/t15-/m0/s1