3-(azepan-1-ylsulfonyl)-N-(furan-2-ylmethyl)-4-methoxy-N-phenyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(furan-2-ylmethyl)-4-methoxy-N-phenyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(2-furylmethyl)-4-methoxy-N-phenyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(2-furanylmethyl)-4-methoxy-N-phenylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(furan-2-ylmethyl)-4-methoxy-N-phenylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-furfuryl)-4-methoxy-N-phenyl-benzamide Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2=CC=CO2)C3=CC=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=CC=CO2)C3=CC=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H28N2O5S/c1-31-23-14-13-20(18-24(23)33(29,30)26-15-7-2-3-8-16-26)25(28)27(19-22-12-9-17-32-22)21-10-5-4-6-11-21/h4-6,9-14,17-18H,2-3,7-8,15-16,19H2,1H3