3-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(4-methoxyphenyl)methylsulfanyl]-2,4-dihydro-1H-1,3,5-triazine

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(4-methoxyphenyl)methylsulfanyl]-2,4-dihydro-1H-1,3,5-triazine Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(4-methoxyphenyl)methylsulfanyl]-2,4-dihydro-1H-1,3,5-triazine CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(4-methoxyphenyl)methylthio]-2,4-dihydro-1H-1,3,5-triazine IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(4-methoxyphenyl)methylsulfanyl]-2,4-dihydro-1H-1,3,5-triazine Traditional Name: 3-homoveratryl-6-(p-anisylthio)-2,4-dihydro-1H-s-triazine Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NCN(CN2)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NCN(CN2)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H27N3O3S/c1-25-18-7-4-17(5-8-18)13-28-21-22-14-24(15-23-21)11-10-16-6-9-19(26-2)20(12-16)27-3/h4-9,12H,10-11,13-15H2,1-3H3,(H,22,23)