N-butan-2-yl-2-[2-[(4-ethoxyphenyl)sulfonyl-(4-fluorophenyl)amino]ethanoylamino]benzamide

Systemtic Name: N-butan-2-yl-2-[2-[(4-ethoxyphenyl)sulfonyl-(4-fluorophenyl)amino]ethanoylamino]benzamide Openeye Name: 2-[[2-(N-(4-ethoxyphenyl)sulfonyl-4-fluoro-anilino)acetyl]amino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[[2-(N-(4-ethoxyphenyl)sulfonyl-4-fluoroanilino)-1-oxoethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-[[2-(N-(4-ethoxyphenyl)sulfonyl-4-fluoroanilino)acetyl]amino]benzamide Traditional Name: 2-[[2-(4-fluoro-N-p-phenetylsulfonyl-anilino)acetyl]amino]-N-sec-butyl-benzamide Formula: C27H30FN3O5S MolecularWeight: 527.607603

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C27H30FN3O5S/c1-4-19(3)29-27(33)24-8-6-7-9-25(24)30-26(32)18-31(21-12-10-20(28)11-13-21)37(34,35)23-16-14-22(15-17-23)36-5-2/h6-17,19H,4-5,18H2,1-3H3,(H,29,33)(H,30,32)