2-[2-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(1-methoxypropan-2-yl)quinazolin-4-one

Systemtic Name: 2-[2-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(1-methoxypropan-2-yl)quinazolin-4-one Openeye Name: 2-[2-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl]sulfanyl-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one CAS Name: 2-[[2-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]thio]-3-(1-methoxypropan-2-yl)-4-quinazolinone IUPAC Name: 2-[2-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-3-(1-methoxypropan-2-yl)quinazolin-4-one Traditional Name: 2-[[2-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethyl]thio]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C(C)COC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C(C)COC

InChI

InChI=1S/C25H27N3O4S/c1-16-12-21(18(3)27(16)13-19-8-7-11-32-19)23(29)15-33-25-26-22-10-6-5-9-20(22)24(30)28(25)17(2)14-31-4/h5-12,17H,13-15H2,1-4H3