6-chloranyl-2-[2-[methyl-(phenylmethyl)amino]ethyl]-3-oxidanylidene-1H-isoindole-5-sulfonamide

Systemtic Name: 6-chloranyl-2-[2-[methyl-(phenylmethyl)amino]ethyl]-3-oxidanylidene-1H-isoindole-5-sulfonamide Openeye Name: 2-[2-[benzyl(methyl)amino]ethyl]-6-chloro-3-oxo-isoindoline-5-sulfonamide CAS Name: 6-chloro-2-[2-[methyl-(phenylmethyl)amino]ethyl]-3-oxo-1H-isoindole-5-sulfonamide IUPAC Name: 2-[2-[benzyl(methyl)amino]ethyl]-6-chloro-3-oxo-1H-isoindole-5-sulfonamide Traditional Name: 2-[2-[benzyl(methyl)amino]ethyl]-6-chloro-3-keto-isoindoline-5-sulfonamide Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1CC2=CC(=C(C=C2C1=O)S(=O)(=O)N)Cl)CC3=CC=CC=C3

Isomeric SMILES

CN(CCN1CC2=CC(=C(C=C2C1=O)S(=O)(=O)N)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H20ClN3O3S/c1-21(11-13-5-3-2-4-6-13)7-8-22-12-14-9-16(19)17(26(20,24)25)10-15(14)18(22)23/h2-6,9-10H,7-8,11-12H2,1H3,(H2,20,24,25)