6-bromanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-1H-indole-2-carboxamide

Systemtic Name: 6-bromanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-1H-indole-2-carboxamide Openeye Name: 6-bromo-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-1H-indole-2-carboxamide CAS Name: 6-bromo-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-1H-indole-2-carboxamide IUPAC Name: 6-bromo-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-1H-indole-2-carboxamide Traditional Name: 6-bromo-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-1H-indole-2-carboxamide Formula: C21H22BrN3O4S MolecularWeight: 492.38608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=CC3=C(N2)C=C(C=C3)Br)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=CC3=C(N2)C=C(C=C3)Br)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H22BrN3O4S/c1-2-29-19-8-7-16(13-20(19)30(27,28)25-9-3-4-10-25)23-21(26)18-11-14-5-6-15(22)12-17(14)24-18/h5-8,11-13,24H,2-4,9-10H2,1H3,(H,23,26)