3-[2-(cyclohexen-1-yl)ethyl]-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-4-one Openeye Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[(1S)-2-oxocyclohexyl]sulfanyl-quinazolin-4-one CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-2-[[(1S)-2-oxocyclohexyl]thio]-4-quinazolinone IUPAC Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[(1S)-2-oxocyclohexyl]sulfanylquinazolin-4-one Traditional Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[[(1S)-2-ketocyclohexyl]thio]quinazolin-4-one Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCN2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O

Isomeric SMILES

C1CCC(=CC1)CCN2C(=O)C3=CC=CC=C3N=C2S[C@H]4CCCCC4=O

InChI

InChI=1S/C22H26N2O2S/c25-19-12-6-7-13-20(19)27-22-23-18-11-5-4-10-17(18)21(26)24(22)15-14-16-8-2-1-3-9-16/h4-5,8,10-11,20H,1-3,6-7,9,12-15H2/t20-/m0/s1