N-[[5-[(dipropylamino)methyl]furan-2-yl]methyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Systemtic Name: N-[[5-[(dipropylamino)methyl]furan-2-yl]methyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: N-[[5-[(dipropylamino)methyl]-2-furyl]methyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: N-[[5-[(dipropylamino)methyl]-2-furanyl]methyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: N-[[5-[(dipropylamino)methyl]furan-2-yl]methyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: N-[[5-[(dipropylamino)methyl]-2-furyl]methyl]-2-keto-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CC1=CC=C(O1)CNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

Isomeric SMILES

CCCN(CCC)CC1=CC=C(O1)CNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

InChI

InChI=1S/C22H31N3O4S/c1-3-12-25(13-4-2)16-19-9-8-18(29-19)15-23-30(27,28)20-10-11-21-17(14-20)6-5-7-22(26)24-21/h8-11,14,23H,3-7,12-13,15-16H2,1-2H3,(H,24,26)