3-(2-methoxyphenyl)-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methoxyphenyl)-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2-methoxyphenyl)-2-[(1S)-2-oxocyclohexyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-methoxyphenyl)-2-[[(1S)-2-oxocyclohexyl]thio]-4-quinazolinone IUPAC Name: 3-(2-methoxyphenyl)-2-[(1S)-2-oxocyclohexyl]sulfanylquinazolin-4-one Traditional Name: 2-[[(1S)-2-ketocyclohexyl]thio]-3-(2-methoxyphenyl)quinazolin-4-one Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2S[C@H]4CCCCC4=O

InChI

InChI=1S/C21H20N2O3S/c1-26-18-12-6-4-10-16(18)23-20(25)14-8-2-3-9-15(14)22-21(23)27-19-13-7-5-11-17(19)24/h2-4,6,8-10,12,19H,5,7,11,13H2,1H3/t19-/m0/s1