tert-butyl N-[5-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-2-methoxy-phenyl]carbamate

Systemtic Name: tert-butyl N-[5-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-2-methoxy-phenyl]carbamate Openeye Name: tert-butyl N-[5-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-2-methoxy-phenyl]carbamate CAS Name: N-[5-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-2-methoxyphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-2-methoxyphenyl]carbamate Traditional Name: N-[5-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]-2-methoxy-phenyl]carbamic acid tert-butyl ester Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC(=C(C=C2)OC)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC(=C(C=C2)OC)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C20H26N4O4S/c1-12-9-13(2)22-18(21-12)29-11-17(25)23-14-7-8-16(27-6)15(10-14)24-19(26)28-20(3,4)5/h7-10H,11H2,1-6H3,(H,23,25)(H,24,26)