2-[2-[(2,7-dimethoxynaphthalen-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[(2,7-dimethoxynaphthalen-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(2,7-dimethoxy-1-naphthyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(2,7-dimethoxy-1-naphthalenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(2,7-dimethoxynaphthalen-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(2,7-dimethoxy-1-naphthyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2CSC3=CC=CC=C3C4=NCCCN4)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2CSC3=CC=CC=C3C4=NCCCN4)OC

InChI

InChI=1S/C23H24N2O2S/c1-26-17-10-8-16-9-11-21(27-2)20(19(16)14-17)15-28-22-7-4-3-6-18(22)23-24-12-5-13-25-23/h3-4,6-11,14H,5,12-13,15H2,1-2H3,(H,24,25)