2-[[(2R)-oxan-2-yl]methylsulfanyl]-3-(3-phenylpropyl)quinazolin-4-one

Systemtic Name: 2-[[(2R)-oxan-2-yl]methylsulfanyl]-3-(3-phenylpropyl)quinazolin-4-one Openeye Name: 3-(3-phenylpropyl)-2-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[(2R)-2-oxanyl]methylthio]-3-(3-phenylpropyl)-4-quinazolinone IUPAC Name: 2-[[(2R)-oxan-2-yl]methylsulfanyl]-3-(3-phenylpropyl)quinazolin-4-one Traditional Name: 3-(3-phenylpropyl)-2-[[(2R)-tetrahydropyran-2-yl]methylthio]quinazolin-4-one Formula: C23H26N2O2S MolecularWeight: 394.52974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

Isomeric SMILES

C1CCO[C@H](C1)CSC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O2S/c26-22-20-13-4-5-14-21(20)24-23(28-17-19-12-6-7-16-27-19)25(22)15-8-11-18-9-2-1-3-10-18/h1-5,9-10,13-14,19H,6-8,11-12,15-17H2/t19-/m1/s1