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

Systemtic Name: N-[3-[(S)-(4-chlorophenyl)-pyrrolidin-1-ium-1-yl-methyl]-4,5-dimethyl-thiophen-2-yl]benzamide Openeye Name: N-[3-[(S)-(4-chlorophenyl)-pyrrolidin-1-ium-1-yl-methyl]-4,5-dimethyl-2-thienyl]benzamide CAS Name: N-[3-[(S)-(4-chlorophenyl)-(1-pyrrolidin-1-iumyl)methyl]-4,5-dimethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[(S)-(4-chlorophenyl)-pyrrolidin-1-ium-1-ylmethyl]-4,5-dimethylthiophen-2-yl]benzamide Traditional Name: N-[3-[(S)-(4-chlorophenyl)-pyrrolidin-1-ium-1-yl-methyl]-4,5-dimethyl-2-thienyl]benzamide Formula: C24H26ClN2OS+ MolecularWeight: 425.99404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CC=C(C=C2)Cl)[NH+]3CCCC3)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1[C@H](C2=CC=C(C=C2)Cl)[NH+]3CCCC3)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C24H25ClN2OS/c1-16-17(2)29-24(26-23(28)19-8-4-3-5-9-19)21(16)22(27-14-6-7-15-27)18-10-12-20(25)13-11-18/h3-5,8-13,22H,6-7,14-15H2,1-2H3,(H,26,28)/p+1/t22-/m0/s1