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

Systemtic Name: 3-chloranyl-N-[(3S)-2-oxidanylidene-1-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide Openeye Name: 3-chloro-N-[(3S)-2-oxo-1-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide CAS Name: 3-chloro-N-[(3S)-2-oxo-1-(1,2,3,4-tetrahydroisoquinolin-7-yl)-3-pyrrolidinyl]-1H-indole-6-sulfonamide IUPAC Name: 3-chloro-N-[(3S)-2-oxo-1-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide Traditional Name: 3-chloro-N-[(3S)-2-keto-1-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrrolidin-3-yl]-1H-indole-6-sulfonamide Formula: C21H21ClN4O3S MolecularWeight: 444.93444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1NS(=O)(=O)C2=CC3=C(C=C2)C(=CN3)Cl)C4=CC5=C(CCNC5)C=C4

Isomeric SMILES

C1CN(C(=O)[C@H]1NS(=O)(=O)C2=CC3=C(C=C2)C(=CN3)Cl)C4=CC5=C(CCNC5)C=C4

InChI

InChI=1S/C21H21ClN4O3S/c22-18-12-24-20-10-16(3-4-17(18)20)30(28,29)25-19-6-8-26(21(19)27)15-2-1-13-5-7-23-11-14(13)9-15/h1-4,9-10,12,19,23-25H,5-8,11H2/t19-/m0/s1