4-[[4-[4-(4-carbamimidoylphenoxy)butoxy]-2-methyl-phenyl]carbamoylamino]benzenesulfonyl fluoride

Systemtic Name: 4-[[4-[4-(4-carbamimidoylphenoxy)butoxy]-2-methyl-phenyl]carbamoylamino]benzenesulfonyl fluoride Openeye Name: 4-[[4-[4-(4-carbamimidoylphenoxy)butoxy]-2-methyl-phenyl]carbamoylamino]benzenesulfonyl fluoride CAS Name: 4-[[[4-[4-(4-carbamimidoylphenoxy)butoxy]-2-methylanilino]-oxomethyl]amino]benzenesulfonyl fluoride IUPAC Name: 4-[[4-[4-(4-carbamimidoylphenoxy)butoxy]-2-methylphenyl]carbamoylamino]benzenesulfonyl fluoride Traditional Name: 4-[[4-[4-(4-amidinophenoxy)butoxy]-2-methyl-phenyl]carbamoylamino]benzenesulfonyl fluoride Formula: C25H27FN4O5S MolecularWeight: 514.569083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCCOC2=CC=C(C=C2)C(=N)N)NC(=O)NC3=CC=C(C=C3)S(=O)(=O)F

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCCOC2=CC=C(C=C2)C(=N)N)NC(=O)NC3=CC=C(C=C3)S(=O)(=O)F

InChI

InChI=1S/C25H27FN4O5S/c1-17-16-21(35-15-3-2-14-34-20-8-4-18(5-9-20)24(27)28)10-13-23(17)30-25(31)29-19-6-11-22(12-7-19)36(26,32)33/h4-13,16H,2-3,14-15H2,1H3,(H3,27,28)(H2,29,30,31)