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

Systemtic Name: 2-[2-[(2-propoxynaphthalen-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(2-propoxy-1-naphthyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(2-propoxy-1-naphthalenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(2-propoxynaphthalen-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(2-propoxy-1-naphthyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C24H26N2OS MolecularWeight: 390.54104

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=CC=CC=C2C=C1)CSC3=CC=CC=C3C4=NCCCN4

Isomeric SMILES

CCCOC1=C(C2=CC=CC=C2C=C1)CSC3=CC=CC=C3C4=NCCCN4

InChI

InChI=1S/C24H26N2OS/c1-2-16-27-22-13-12-18-8-3-4-9-19(18)21(22)17-28-23-11-6-5-10-20(23)24-25-14-7-15-26-24/h3-6,8-13H,2,7,14-17H2,1H3,(H,25,26)