3-chloranyl-N-[(3S)-2-oxidanylidene-1-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide

Systemtic Name: 3-chloranyl-N-[(3S)-2-oxidanylidene-1-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide Openeye Name: 3-chloro-N-[(3S)-2-oxo-1-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide CAS Name: 3-chloro-N-[(3S)-2-oxo-1-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)-3-pyrrolidinyl]-1H-indole-6-sulfonamide IUPAC Name: 3-chloro-N-[(3S)-2-oxo-1-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide Traditional Name: 3-chloro-N-[(3S)-2-keto-1-(2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CNC1)C=CC(=C2)N3CCC(C3=O)NS(=O)(=O)C4=CC5=C(C=C4)C(=CN5)Cl

Isomeric SMILES

C1CC2=C(CNC1)C=CC(=C2)N3CC[C@@H](C3=O)NS(=O)(=O)C4=CC5=C(C=C4)C(=CN5)Cl

InChI

InChI=1S/C22H23ClN4O3S/c23-19-13-25-21-11-17(5-6-18(19)21)31(29,30)26-20-7-9-27(22(20)28)16-4-3-15-12-24-8-1-2-14(15)10-16/h3-6,10-11,13,20,24-26H,1-2,7-9,12H2/t20-/m0/s1