2-[3-methoxy-2-(naphthalen-1-ylsulfanylmethyl)phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol

Systemtic Name: 2-[3-methoxy-2-(naphthalen-1-ylsulfanylmethyl)phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Openeye Name: 2-[3-methoxy-2-(1-naphthylsulfanylmethyl)phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol CAS Name: 2-[3-methoxy-2-[(1-naphthalenylthio)methyl]phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol IUPAC Name: 2-[3-methoxy-2-(naphthalen-1-ylsulfanylmethyl)phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Traditional Name: 2-[3-methoxy-2-[(1-naphthylthio)methyl]phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1CSC2=CC=CC3=CC=CC=C32)C4=NCC(CN4)O

Isomeric SMILES

COC1=CC=CC(=C1CSC2=CC=CC3=CC=CC=C32)C4=NCC(CN4)O

InChI

InChI=1S/C22H22N2O2S/c1-26-20-10-5-9-18(22-23-12-16(25)13-24-22)19(20)14-27-21-11-4-7-15-6-2-3-8-17(15)21/h2-11,16,25H,12-14H2,1H3,(H,23,24)