N-[4-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]carbamoyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]carbamoyl]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]carbamoyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[3-(1-azepanylsulfonyl)-4-methylanilino]-oxomethyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[3-(azepan-1-ylsulfonyl)-4-methylphenyl]carbamoyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]carbamoyl]phenyl]-2-furamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H27N3O5S/c1-18-8-11-21(17-23(18)34(31,32)28-14-4-2-3-5-15-28)27-24(29)19-9-12-20(13-10-19)26-25(30)22-7-6-16-33-22/h6-13,16-17H,2-5,14-15H2,1H3,(H,26,30)(H,27,29)