N-[3-[cyclopentyl(furan-2-ylmethyl)amino]propyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Systemtic Name: N-[3-[cyclopentyl(furan-2-ylmethyl)amino]propyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: N-[3-[cyclopentyl(2-furylmethyl)amino]propyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: N-[3-[cyclopentyl(2-furanylmethyl)amino]propyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: N-[3-[cyclopentyl(furan-2-ylmethyl)amino]propyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: N-[3-[cyclopentyl(2-furfuryl)amino]propyl]-2-keto-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3)CC4=CC=CO4

Isomeric SMILES

C1CCC(C1)N(CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3)CC4=CC=CO4

InChI

InChI=1S/C23H31N3O4S/c27-23-10-3-6-18-16-21(11-12-22(18)25-23)31(28,29)24-13-5-14-26(19-7-1-2-8-19)17-20-9-4-15-30-20/h4,9,11-12,15-16,19,24H,1-3,5-8,10,13-14,17H2,(H,25,27)