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

Systemtic Name: 2-[3-methoxy-2-(naphthalen-1-ylsulfanylmethyl)phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[3-methoxy-2-(1-naphthylsulfanylmethyl)phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[3-methoxy-2-[(1-naphthalenylthio)methyl]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[3-methoxy-2-(naphthalen-1-ylsulfanylmethyl)phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[3-methoxy-2-[(1-naphthylthio)methyl]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C22H22N2OS MolecularWeight: 362.48788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1CSC2=CC=CC3=CC=CC=C32)C4=NCCCN4

Isomeric SMILES

COC1=CC=CC(=C1CSC2=CC=CC3=CC=CC=C32)C4=NCCCN4

InChI

InChI=1S/C22H22N2OS/c1-25-20-11-5-10-18(22-23-13-6-14-24-22)19(20)15-26-21-12-4-8-16-7-2-3-9-17(16)21/h2-5,7-12H,6,13-15H2,1H3,(H,23,24)