2-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(1-methoxypropan-2-yl)quinazolin-4-one

Systemtic Name: 2-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(1-methoxypropan-2-yl)quinazolin-4-one Openeye Name: 2-[2-(4-ethoxyphenyl)-2-oxo-ethyl]sulfanyl-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one CAS Name: 2-[[2-(4-ethoxyphenyl)-2-oxoethyl]thio]-3-(1-methoxypropan-2-yl)-4-quinazolinone IUPAC Name: 2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-3-(1-methoxypropan-2-yl)quinazolin-4-one Traditional Name: 2-[(2-keto-2-p-phenetyl-ethyl)thio]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)COC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)COC

InChI

InChI=1S/C22H24N2O4S/c1-4-28-17-11-9-16(10-12-17)20(25)14-29-22-23-19-8-6-5-7-18(19)21(26)24(22)15(2)13-27-3/h5-12,15H,4,13-14H2,1-3H3