N-[2-(azepan-1-yl)phenyl]-5-piperidin-1-ylsulfonyl-furan-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-5-piperidin-1-ylsulfonyl-furan-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-5-(1-piperidylsulfonyl)furan-2-carboxamide CAS Name: N-[2-(1-azepanyl)phenyl]-5-(1-piperidinylsulfonyl)-2-furancarboxamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-5-piperidin-1-ylsulfonylfuran-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-5-piperidinosulfonyl-2-furamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(O3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(O3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H29N3O4S/c26-22(20-12-13-21(29-20)30(27,28)25-16-8-3-9-17-25)23-18-10-4-5-11-19(18)24-14-6-1-2-7-15-24/h4-5,10-13H,1-3,6-9,14-17H2,(H,23,26)