N-[4-(4-ethylsulfonylpiperazin-1-yl)phenyl]-6-fluoranyl-8-(4-methylpiperazin-1-yl)-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-[4-(4-ethylsulfonylpiperazin-1-yl)phenyl]-6-fluoranyl-8-(4-methylpiperazin-1-yl)-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-[4-(4-ethylsulfonylpiperazin-1-yl)phenyl]-6-fluoro-8-(4-methylpiperazin-1-yl)-4-oxo-chromene-2-carboxamide CAS Name: N-[4-(4-ethylsulfonyl-1-piperazinyl)phenyl]-6-fluoro-8-(4-methyl-1-piperazinyl)-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-[4-(4-ethylsulfonylpiperazin-1-yl)phenyl]-6-fluoro-8-(4-methylpiperazin-1-yl)-4-oxochromene-2-carboxamide Traditional Name: N-[4-(4-esylpiperazino)phenyl]-6-fluoro-4-keto-8-(4-methylpiperazino)chromene-2-carboxamide Formula: C27H32FN5O5S MolecularWeight: 557.636883

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=O)C4=CC(=CC(=C4O3)N5CCN(CC5)C)F

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=O)C4=CC(=CC(=C4O3)N5CCN(CC5)C)F

InChI

InChI=1S/C27H32FN5O5S/c1-3-39(36,37)33-14-12-31(13-15-33)21-6-4-20(5-7-21)29-27(35)25-18-24(34)22-16-19(28)17-23(26(22)38-25)32-10-8-30(2)9-11-32/h4-7,16-18H,3,8-15H2,1-2H3,(H,29,35)