[2,6-dimethyl-4-[2-(phenylmethylsulfanyl)phenyl]-1,4-dihydropyridin-3-yl] methyl carbonate

Systemtic Name: [2,6-dimethyl-4-[2-(phenylmethylsulfanyl)phenyl]-1,4-dihydropyridin-3-yl] methyl carbonate Openeye Name: [4-(2-benzylsulfanylphenyl)-2,6-dimethyl-1,4-dihydropyridin-3-yl] methyl carbonate CAS Name: carbonic acid [2,6-dimethyl-4-[2-(phenylmethylthio)phenyl]-1,4-dihydropyridin-3-yl] methyl ester IUPAC Name: [4-(2-benzylsulfanylphenyl)-2,6-dimethyl-1,4-dihydropyridin-3-yl] methyl carbonate Traditional Name: carbonic acid [4-[2-(benzylthio)phenyl]-2,6-dimethyl-1,4-dihydropyridin-3-yl] methyl ester Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(=C(N1)C)OC(=O)OC)C2=CC=CC=C2SCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(C(=C(N1)C)OC(=O)OC)C2=CC=CC=C2SCC3=CC=CC=C3

InChI

InChI=1S/C22H23NO3S/c1-15-13-19(21(16(2)23-15)26-22(24)25-3)18-11-7-8-12-20(18)27-14-17-9-5-4-6-10-17/h4-13,19,23H,14H2,1-3H3