N-[4,5-dimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)thiophen-2-yl]benzamide

Systemtic Name: N-[4,5-dimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)thiophen-2-yl]benzamide Openeye Name: N-[4,5-dimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)-2-thienyl]benzamide CAS Name: N-[4,5-dimethyl-3-(1-pyrrolidin-1-iumylmethyl)-2-thiophenyl]benzamide IUPAC Name: N-[4,5-dimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)thiophen-2-yl]benzamide Traditional Name: N-[4,5-dimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)-2-thienyl]benzamide Formula: C18H23N2OS+ MolecularWeight: 315.45302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C[NH+]2CCCC2)NC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C[NH+]2CCCC2)NC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C18H22N2OS/c1-13-14(2)22-18(16(13)12-20-10-6-7-11-20)19-17(21)15-8-4-3-5-9-15/h3-5,8-9H,6-7,10-12H2,1-2H3,(H,19,21)/p+1