N-[2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-5-(phenylsulfonyl)furan-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-5-(phenylsulfonyl)furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(2-thienyl)ethyl]-5-(benzenesulfonyl)furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-thiophen-2-ylethyl]-5-(benzenesulfonyl)-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-2-ylethyl]-5-(benzenesulfonyl)furan-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(2-thienyl)ethyl]-5-besyl-2-furamide Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)C(CNC(=O)C2=CC=C(O2)S(=O)(=O)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H26N2O4S2/c26-23(20-12-13-22(29-20)31(27,28)18-9-4-3-5-10-18)24-17-19(21-11-8-16-30-21)25-14-6-1-2-7-15-25/h3-5,8-13,16,19H,1-2,6-7,14-15,17H2,(H,24,26)