3-cyclopentyl-2-[[2-(4-ethoxy-3-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-cyclopentyl-2-[[2-(4-ethoxy-3-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclopentyl-2-[[2-(4-ethoxy-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-cyclopentyl-2-[[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-4-quinazolinone IUPAC Name: 3-cyclopentyl-2-[[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclopentyl-2-[[2-(4-ethoxy-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methylthio]quinazolin-4-one Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=C(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3C5CCCC5)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=C(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3C5CCCC5)OC

InChI

InChI=1S/C27H29N3O4S/c1-4-33-23-14-13-18(15-24(23)32-3)25-28-22(17(2)34-25)16-35-27-29-21-12-8-7-11-20(21)26(31)30(27)19-9-5-6-10-19/h7-8,11-15,19H,4-6,9-10,16H2,1-3H3