5-bromanyl-N-[2-fluoranyl-3-[4-methyl-6-[(4-morpholin-4-ylcarbonylphenyl)amino]-5-oxidanylidene-pyrazin-2-yl]phenyl]thiophene-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2-fluoranyl-3-[4-methyl-6-[(4-morpholin-4-ylcarbonylphenyl)amino]-5-oxidanylidene-pyrazin-2-yl]phenyl]thiophene-2-carboxamide Openeye Name: 5-bromo-N-[2-fluoro-3-[4-methyl-6-[4-(morpholine-4-carbonyl)anilino]-5-oxo-pyrazin-2-yl]phenyl]thiophene-2-carboxamide CAS Name: 5-bromo-N-[2-fluoro-3-[4-methyl-6-[4-[4-morpholinyl(oxo)methyl]anilino]-5-oxo-2-pyrazinyl]phenyl]-2-thiophenecarboxamide IUPAC Name: 5-bromo-N-[2-fluoro-3-[4-methyl-6-[4-(morpholine-4-carbonyl)anilino]-5-oxopyrazin-2-yl]phenyl]thiophene-2-carboxamide Traditional Name: 5-bromo-N-[2-fluoro-3-[5-keto-4-methyl-6-[4-(morpholine-4-carbonyl)anilino]pyrazin-2-yl]phenyl]thiophene-2-carboxamide Formula: C27H23BrFN5O4S MolecularWeight: 612.470023

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C(C1=O)NC2=CC=C(C=C2)C(=O)N3CCOCC3)C4=C(C(=CC=C4)NC(=O)C5=CC=C(S5)Br)F

Isomeric SMILES

CN1C=C(N=C(C1=O)NC2=CC=C(C=C2)C(=O)N3CCOCC3)C4=C(C(=CC=C4)NC(=O)C5=CC=C(S5)Br)F

InChI

InChI=1S/C27H23BrFN5O4S/c1-33-15-20(18-3-2-4-19(23(18)29)32-25(35)21-9-10-22(28)39-21)31-24(27(33)37)30-17-7-5-16(6-8-17)26(36)34-11-13-38-14-12-34/h2-10,15H,11-14H2,1H3,(H,30,31)(H,32,35)