3-(2-methoxy-5-methyl-phenyl)-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methoxy-5-methyl-phenyl)-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2-methoxy-5-methyl-phenyl)-2-[(1S)-2-oxocyclohexyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-methoxy-5-methylphenyl)-2-[[(1S)-2-oxocyclohexyl]thio]-4-quinazolinone IUPAC Name: 3-(2-methoxy-5-methylphenyl)-2-[(1S)-2-oxocyclohexyl]sulfanylquinazolin-4-one Traditional Name: 2-[[(1S)-2-ketocyclohexyl]thio]-3-(2-methoxy-5-methyl-phenyl)quinazolin-4-one Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2S[C@H]4CCCCC4=O

InChI

InChI=1S/C22H22N2O3S/c1-14-11-12-19(27-2)17(13-14)24-21(26)15-7-3-4-8-16(15)23-22(24)28-20-10-6-5-9-18(20)25/h3-4,7-8,11-13,20H,5-6,9-10H2,1-2H3/t20-/m0/s1