3-(2-ethylphenyl)-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2-ethylphenyl)-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(2-ethylphenyl)-2-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(2-ethylphenyl)-2-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methylthio]-4-quinazolinone IUPAC Name: 3-(2-ethylphenyl)-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2-ethylphenyl)-2-[(5-pyrrolidinosulfonyl-2-furyl)methylthio]quinazolin-4-one Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(O4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(O4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H25N3O4S2/c1-2-18-9-3-6-12-22(18)28-24(29)20-10-4-5-11-21(20)26-25(28)33-17-19-13-14-23(32-19)34(30,31)27-15-7-8-16-27/h3-6,9-14H,2,7-8,15-17H2,1H3