4-(1,3-dithiolan-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]benzamide

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]benzamide Openeye Name: 4-(1,3-dithiolan-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide Traditional Name: 4-(1,3-dithiolan-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]benzamide Formula: C23H28N2O2S2 MolecularWeight: 428.61062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=CC=C(C=C2)C3SCCS3)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C2=CC=C(C=C2)C3SCCS3)N4CCCC4

InChI

InChI=1S/C23H28N2O2S2/c1-27-20-6-4-5-19(15-20)21(25-11-2-3-12-25)16-24-22(26)17-7-9-18(10-8-17)23-28-13-14-29-23/h4-10,15,21,23H,2-3,11-14,16H2,1H3,(H,24,26)