5-[(2S)-1-[(2,3-dimethyl-1H-indol-7-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-[(2,3-dimethyl-1H-indol-7-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-[(2,3-dimethyl-1H-indol-7-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: 5-[(2S)-1-[(2,3-dimethyl-1H-indol-7-yl)methyl]-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-[(2,3-dimethyl-1H-indol-7-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-[(2,3-dimethyl-1H-indol-7-yl)methyl]pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=CC=C2C[NH+]3CCCC3C4=CC=C(S4)C(=O)N)C

Isomeric SMILES

CC1=C(NC2=C1C=CC=C2C[NH+]3CCC[C@H]3C4=CC=C(S4)C(=O)N)C

InChI

InChI=1S/C20H23N3OS/c1-12-13(2)22-19-14(5-3-6-15(12)19)11-23-10-4-7-16(23)17-8-9-18(25-17)20(21)24/h3,5-6,8-9,16,22H,4,7,10-11H2,1-2H3,(H2,21,24)/p+1/t16-/m0/s1