2-[2-[(5-ethyl-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[(5-ethyl-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(5-ethyl-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(5-ethyl-2-methoxy-1-cyclohexa-2,4-dienyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(5-ethyl-2-methoxycyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(5-ethyl-2-methoxy-cyclohexa-2,4-dien-1-yl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C20H26N2OS MolecularWeight: 342.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C(C1)CSC2=CC=CC=C2C3=NCCCN3)OC

Isomeric SMILES

CCC1=CC=C(C(C1)CSC2=CC=CC=C2C3=NCCCN3)OC

InChI

InChI=1S/C20H26N2OS/c1-3-15-9-10-18(23-2)16(13-15)14-24-19-8-5-4-7-17(19)20-21-11-6-12-22-20/h4-5,7-10,16H,3,6,11-14H2,1-2H3,(H,21,22)