tert-butyl N-[4-[2,3-bis(azanyl)pyridin-4-yl]oxy-2-methylsulfanyl-phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[2,3-bis(azanyl)pyridin-4-yl]oxy-2-methylsulfanyl-phenyl]carbamate Openeye Name: tert-butyl N-[4-[(2,3-diamino-4-pyridyl)oxy]-2-methylsulfanyl-phenyl]carbamate CAS Name: N-[4-[(2,3-diamino-4-pyridinyl)oxy]-2-(methylthio)phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(2,3-diaminopyridin-4-yl)oxy-2-methylsulfanylphenyl]carbamate Traditional Name: N-[4-[(2,3-diamino-4-pyridyl)oxy]-2-(methylthio)phenyl]carbamic acid tert-butyl ester Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)OC2=C(C(=NC=C2)N)N)SC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)OC2=C(C(=NC=C2)N)N)SC

InChI

InChI=1S/C17H22N4O3S/c1-17(2,3)24-16(22)21-11-6-5-10(9-13(11)25-4)23-12-7-8-20-15(19)14(12)18/h5-9H,18H2,1-4H3,(H2,19,20)(H,21,22)