[3-[4-[(5-ethyl-2-methoxy-6-methyl-pyridin-3-yl)amino]piperazin-1-yl]-5-methoxy-phenyl] methylsulfanylmethanoate

Systemtic Name: [3-[4-[(5-ethyl-2-methoxy-6-methyl-pyridin-3-yl)amino]piperazin-1-yl]-5-methoxy-phenyl] methylsulfanylmethanoate Openeye Name: [3-[4-[(5-ethyl-2-methoxy-6-methyl-3-pyridyl)amino]piperazin-1-yl]-5-methoxy-phenyl] methylsulfanylformate CAS Name: (methylthio)formic acid [3-[4-[(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)amino]-1-piperazinyl]-5-methoxyphenyl] ester IUPAC Name: [3-[4-[(5-ethyl-2-methoxy-6-methylpyridin-3-yl)amino]piperazin-1-yl]-5-methoxyphenyl] methylsulfanylformate Traditional Name: (methylthio)formic acid [3-[4-[(5-ethyl-2-methoxy-6-methyl-3-pyridyl)amino]piperazino]-5-methoxy-phenyl] ester Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(N=C1C)OC)NN2CCN(CC2)C3=CC(=CC(=C3)OC)OC(=O)SC

Isomeric SMILES

CCC1=CC(=C(N=C1C)OC)NN2CCN(CC2)C3=CC(=CC(=C3)OC)OC(=O)SC

InChI

InChI=1S/C22H30N4O4S/c1-6-16-11-20(21(29-4)23-15(16)2)24-26-9-7-25(8-10-26)17-12-18(28-3)14-19(13-17)30-22(27)31-5/h11-14,24H,6-10H2,1-5H3