N-[[4-(furan-2-ylcarbonylamino)phenyl]methyl]-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-[[4-(furan-2-ylcarbonylamino)phenyl]methyl]-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carboxamide Openeye Name: N-[[4-(furan-2-carbonylamino)phenyl]methyl]-4-(p-tolylsulfonyl)-1,4-diazepane-1-carboxamide CAS Name: N-[[4-[[2-furanyl(oxo)methyl]amino]phenyl]methyl]-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carboxamide IUPAC Name: N-[[4-(furan-2-carbonylamino)phenyl]methyl]-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carboxamide Traditional Name: N-[4-(2-furoylamino)benzyl]-4-tosyl-1,4-diazepane-1-carboxamide Formula: C25H28N4O5S MolecularWeight: 496.57862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)NCC3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)NCC3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C25H28N4O5S/c1-19-5-11-22(12-6-19)35(32,33)29-14-3-13-28(15-16-29)25(31)26-18-20-7-9-21(10-8-20)27-24(30)23-4-2-17-34-23/h2,4-12,17H,3,13-16,18H2,1H3,(H,26,31)(H,27,30)