3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[2-(2-furyl)-2-(1-piperidyl)ethyl]propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[2-(2-furyl)-2-piperidino-ethyl]propionamide Formula: C26H37N3O4S MolecularWeight: 487.65468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC(C3=CC=CO3)N4CCCCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC(C3=CC=CO3)N4CCCCC4

InChI

InChI=1S/C26H37N3O4S/c30-26(27-21-24(25-9-8-20-33-25)28-16-4-3-5-17-28)15-12-22-10-13-23(14-11-22)34(31,32)29-18-6-1-2-7-19-29/h8-11,13-14,20,24H,1-7,12,15-19,21H2,(H,27,30)