2-[5-bromanyl-2-[(5-bromanyl-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-1,3-diazinane

Systemtic Name: 2-[5-bromanyl-2-[(5-bromanyl-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-1,3-diazinane Openeye Name: 2-[5-bromo-2-[(5-bromo-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]hexahydropyrimidine CAS Name: 2-[5-bromo-2-[(5-bromo-2-methoxy-1-cyclohexa-2,4-dienyl)methylthio]phenyl]-1,3-diazinane IUPAC Name: 2-[5-bromo-2-[(5-bromo-2-methoxycyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-1,3-diazinane Traditional Name: 2-[5-bromo-2-[(5-bromo-2-methoxy-cyclohexa-2,4-dien-1-yl)methylthio]phenyl]hexahydropyrimidine Formula: C18H22Br2N2OS MolecularWeight: 474.25308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(CC1CSC2=C(C=C(C=C2)Br)C3NCCCN3)Br

Isomeric SMILES

COC1=CC=C(CC1CSC2=C(C=C(C=C2)Br)C3NCCCN3)Br

InChI

InChI=1S/C18H22Br2N2OS/c1-23-16-5-3-13(19)9-12(16)11-24-17-6-4-14(20)10-15(17)18-21-7-2-8-22-18/h3-6,10,12,18,21-22H,2,7-9,11H2,1H3