2-[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl]amino]-N-propyl-ethanamide

Systemtic Name: 2-[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl]amino]-N-propyl-ethanamide Openeye Name: 2-[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl]amino]-N-propyl-acetamide CAS Name: 2-[[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-propylacetamide IUPAC Name: 2-[[cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]carbamothioyl]amino]-N-propylacetamide Traditional Name: 2-[[cyclopentyl-(3,4,5-trimethoxybenzyl)thiocarbamoyl]amino]-N-propyl-acetamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=S)N(CC1=CC(=C(C(=C1)OC)OC)OC)C2CCCC2

Isomeric SMILES

CCCNC(=O)CNC(=S)N(CC1=CC(=C(C(=C1)OC)OC)OC)C2CCCC2

InChI

InChI=1S/C21H33N3O4S/c1-5-10-22-19(25)13-23-21(29)24(16-8-6-7-9-16)14-15-11-17(26-2)20(28-4)18(12-15)27-3/h11-12,16H,5-10,13-14H2,1-4H3,(H,22,25)(H,23,29)