N-[2-methyl-5-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[2-methyl-5-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]furan-2-carboxamide Openeye Name: N-[2-methyl-5-[4-(p-tolylsulfonyl)-1,4-diazepane-1-carbonyl]phenyl]furan-2-carboxamide CAS Name: N-[2-methyl-5-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]phenyl]-2-furancarboxamide IUPAC Name: N-[2-methyl-5-[4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbonyl]phenyl]furan-2-carboxamide Traditional Name: N-[2-methyl-5-(4-tosyl-1,4-diazepane-1-carbonyl)phenyl]-2-furamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O5S/c1-18-6-10-21(11-7-18)34(31,32)28-13-4-12-27(14-15-28)25(30)20-9-8-19(2)22(17-20)26-24(29)23-5-3-16-33-23/h3,5-11,16-17H,4,12-15H2,1-2H3,(H,26,29)