2-[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl]amino]ethanoate

Systemtic Name: 2-[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl]amino]ethanoate Openeye Name: 2-[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl]amino]acetate CAS Name: 2-[[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]acetate IUPAC Name: 2-[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl]amino]acetate Traditional Name: 2-[[cyclopentyl-(3,4,5-trimethoxybenzyl)thiocarbamoyl]amino]acetate Formula: C18H25N2O5S- MolecularWeight: 381.4665

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN(C2CCCC2)C(=S)NCC(=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN(C2CCCC2)C(=S)NCC(=O)[O-]

InChI

InChI=1S/C18H26N2O5S/c1-23-14-8-12(9-15(24-2)17(14)25-3)11-20(13-6-4-5-7-13)18(26)19-10-16(21)22/h8-9,13H,4-7,10-11H2,1-3H3,(H,19,26)(H,21,22)/p-1