methyl 5-[[3-aminocarbonyl-5-[2-fluoranyl-4-(2-oxidanylpropan-2-yl)phenyl]thiophen-2-yl]amino]pyrazine-2-carboxylate

Systemtic Name: methyl 5-[[3-aminocarbonyl-5-[2-fluoranyl-4-(2-oxidanylpropan-2-yl)phenyl]thiophen-2-yl]amino]pyrazine-2-carboxylate Openeye Name: methyl 5-[[3-carbamoyl-5-[2-fluoro-4-(1-hydroxy-1-methyl-ethyl)phenyl]-2-thienyl]amino]pyrazine-2-carboxylate CAS Name: 5-[[3-carbamoyl-5-[2-fluoro-4-(2-hydroxypropan-2-yl)phenyl]-2-thiophenyl]amino]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-carbamoyl-5-[2-fluoro-4-(2-hydroxypropan-2-yl)phenyl]thiophen-2-yl]amino]pyrazine-2-carboxylate Traditional Name: 5-[[3-carbamoyl-5-[2-fluoro-4-(1-hydroxy-1-methyl-ethyl)phenyl]-2-thienyl]amino]pyrazinic acid methyl ester Formula: C20H19FN4O4S MolecularWeight: 430.452663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C(C=C1)C2=CC(=C(S2)NC3=NC=C(N=C3)C(=O)OC)C(=O)N)F)O

Isomeric SMILES

CC(C)(C1=CC(=C(C=C1)C2=CC(=C(S2)NC3=NC=C(N=C3)C(=O)OC)C(=O)N)F)O

InChI

InChI=1S/C20H19FN4O4S/c1-20(2,28)10-4-5-11(13(21)6-10)15-7-12(17(22)26)18(30-15)25-16-9-23-14(8-24-16)19(27)29-3/h4-9,28H,1-3H3,(H2,22,26)(H,24,25)