tert-butyl 2-azanyl-6-[2-(cyclopropylmethoxy)-6-[(4-methoxyphenyl)methoxy]phenyl]-4-methylsulfinyl-pyridine-3-carboxylate

Systemtic Name: tert-butyl 2-azanyl-6-[2-(cyclopropylmethoxy)-6-[(4-methoxyphenyl)methoxy]phenyl]-4-methylsulfinyl-pyridine-3-carboxylate Openeye Name: tert-butyl 2-amino-6-[2-(cyclopropylmethoxy)-6-[(4-methoxyphenyl)methoxy]phenyl]-4-methylsulfinyl-pyridine-3-carboxylate CAS Name: 2-amino-6-[2-(cyclopropylmethoxy)-6-[(4-methoxyphenyl)methoxy]phenyl]-4-methylsulfinyl-3-pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-6-[2-(cyclopropylmethoxy)-6-[(4-methoxyphenyl)methoxy]phenyl]-4-methylsulfinylpyridine-3-carboxylate Traditional Name: 2-amino-6-[2-(cyclopropylmethoxy)-6-p-anisyloxy-phenyl]-4-methylsulfinyl-nicotinic acid tert-butyl ester Formula: C29H34N2O6S MolecularWeight: 538.65506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(N=C(C=C1S(=O)C)C2=C(C=CC=C2OCC3CC3)OCC4=CC=C(C=C4)OC)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(N=C(C=C1S(=O)C)C2=C(C=CC=C2OCC3CC3)OCC4=CC=C(C=C4)OC)N

InChI

InChI=1S/C29H34N2O6S/c1-29(2,3)37-28(32)26-24(38(5)33)15-21(31-27(26)30)25-22(35-16-18-9-10-18)7-6-8-23(25)36-17-19-11-13-20(34-4)14-12-19/h6-8,11-15,18H,9-10,16-17H2,1-5H3,(H2,30,31)