3-acetamido-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[2-(pyrrolidinomethyl)benzyl]-3-(2-thienyl)propionamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NCC1=CC=CC=C1CN2CCCC2)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)NCC1=CC=CC=C1CN2CCCC2)C3=CC=CS3

InChI

InChI=1S/C21H27N3O2S/c1-16(25)23-19(20-9-6-12-27-20)13-21(26)22-14-17-7-2-3-8-18(17)15-24-10-4-5-11-24/h2-3,6-9,12,19H,4-5,10-11,13-15H2,1H3,(H,22,26)(H,23,25)