N-[3-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoylamino]-4-methyl-phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoylamino]-4-methyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]amino]-4-methyl-phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[2-[(4-fluorophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-4-methylphenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[2-[(4-fluorophenyl)sulfonyl-methylamino]acetyl]amino]-4-methylphenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]amino]-4-methyl-phenyl]cyclopropanecarboxamide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O4S/c1-13-3-8-16(22-20(26)14-4-5-14)11-18(13)23-19(25)12-24(2)29(27,28)17-9-6-15(21)7-10-17/h3,6-11,14H,4-5,12H2,1-2H3,(H,22,26)(H,23,25)