6,7-bis(chloranyl)-N-(2,2-dimethylpropyl)-1-(3-sulfonylpropyl)indole-3-carboxamide

Systemtic Name: 6,7-bis(chloranyl)-N-(2,2-dimethylpropyl)-1-(3-sulfonylpropyl)indole-3-carboxamide Openeye Name: 6,7-dichloro-N-(2,2-dimethylpropyl)-1-(3-sulfonylpropyl)indole-3-carboxamide CAS Name: 6,7-dichloro-N-(2,2-dimethylpropyl)-1-(3-sulfonylpropyl)-3-indolecarboxamide IUPAC Name: 6,7-dichloro-N-(2,2-dimethylpropyl)-1-(3-sulfonylpropyl)indole-3-carboxamide Traditional Name: 6,7-dichloro-N-neopentyl-1-(3-sulfonylpropyl)indole-3-carboxamide Formula: C17H20Cl2N2O3S MolecularWeight: 403.3233

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)C1=CN(C2=C1C=CC(=C2Cl)Cl)CCC=S(=O)=O

Isomeric SMILES

CC(C)(C)CNC(=O)C1=CN(C2=C1C=CC(=C2Cl)Cl)CCC=S(=O)=O

InChI

InChI=1S/C17H20Cl2N2O3S/c1-17(2,3)10-20-16(22)12-9-21(7-4-8-25(23)24)15-11(12)5-6-13(18)14(15)19/h5-6,8-9H,4,7,10H2,1-3H3,(H,20,22)