2-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-3-(3-phenylpropyl)quinazolin-4-one

Systemtic Name: 2-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-3-(3-phenylpropyl)quinazolin-4-one Openeye Name: 2-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-3-(3-phenylpropyl)quinazolin-4-one CAS Name: 2-[[(4R)-1,3-dioxan-4-yl]methylthio]-3-(3-phenylpropyl)-4-quinazolinone IUPAC Name: 2-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-3-(3-phenylpropyl)quinazolin-4-one Traditional Name: 2-[[(4R)-1,3-dioxan-4-yl]methylthio]-3-(3-phenylpropyl)quinazolin-4-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

C1COCOC1CSC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

Isomeric SMILES

C1COCO[C@H]1CSC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3S/c25-21-19-10-4-5-11-20(19)23-22(28-15-18-12-14-26-16-27-18)24(21)13-6-9-17-7-2-1-3-8-17/h1-5,7-8,10-11,18H,6,9,12-16H2/t18-/m1/s1