N-(furan-2-ylmethyl)-2-[4-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[4-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide Openeye Name: N-(2-furylmethyl)-2-[4-(4-methyl-N-methylsulfonyl-anilino)butanoylamino]benzamide CAS Name: N-(2-furanylmethyl)-2-[[4-(4-methyl-N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-2-[4-(4-methyl-N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: N-(2-furfuryl)-2-[4-(N-mesyl-4-methyl-anilino)butanoylamino]benzamide Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)S(=O)(=O)C

InChI

InChI=1S/C24H27N3O5S/c1-18-11-13-19(14-12-18)27(33(2,30)31)15-5-10-23(28)26-22-9-4-3-8-21(22)24(29)25-17-20-7-6-16-32-20/h3-4,6-9,11-14,16H,5,10,15,17H2,1-2H3,(H,25,29)(H,26,28)