N-[2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-5-(4-methylphenyl)sulfonyl-furan-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-5-(4-methylphenyl)sulfonyl-furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(2-thienyl)ethyl]-5-(p-tolylsulfonyl)furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-thiophen-2-ylethyl]-5-(4-methylphenyl)sulfonyl-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-2-ylethyl]-5-(4-methylphenyl)sulfonylfuran-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(2-thienyl)ethyl]-5-tosyl-2-furamide Formula: C24H28N2O4S2 MolecularWeight: 472.62012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O2)C(=O)NCC(C3=CC=CS3)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O2)C(=O)NCC(C3=CC=CS3)N4CCCCCC4

InChI

InChI=1S/C24H28N2O4S2/c1-18-8-10-19(11-9-18)32(28,29)23-13-12-21(30-23)24(27)25-17-20(22-7-6-16-31-22)26-14-4-2-3-5-15-26/h6-13,16,20H,2-5,14-15,17H2,1H3,(H,25,27)