2-[(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(1S)-2-(4-ethoxyphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 2-[[(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[[(1S)-2-keto-1-methyl-2-p-phenetyl-ethyl]thio]quinazolin-4-one Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C22H22N2O3S/c1-4-14-24-21(26)18-8-6-7-9-19(18)23-22(24)28-15(3)20(25)16-10-12-17(13-11-16)27-5-2/h4,6-13,15H,1,5,14H2,2-3H3/t15-/m0/s1