N-butyl-2-[[(phenylmethyl)-(pyridin-3-ylmethyl)carbamothioyl]amino]ethanamide

Systemtic Name: N-butyl-2-[[(phenylmethyl)-(pyridin-3-ylmethyl)carbamothioyl]amino]ethanamide Openeye Name: 2-[[benzyl(3-pyridylmethyl)carbamothioyl]amino]-N-butyl-acetamide CAS Name: N-butyl-2-[[[(phenylmethyl)-(3-pyridinylmethyl)amino]-sulfanylidenemethyl]amino]acetamide IUPAC Name: 2-[[benzyl(pyridin-3-ylmethyl)carbamothioyl]amino]-N-butylacetamide Traditional Name: 2-[[benzyl(3-pyridylmethyl)thiocarbamoyl]amino]-N-butyl-acetamide Formula: C20H26N4OS MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CNC(=S)N(CC1=CC=CC=C1)CC2=CN=CC=C2

Isomeric SMILES

CCCCNC(=O)CNC(=S)N(CC1=CC=CC=C1)CC2=CN=CC=C2

InChI

InChI=1S/C20H26N4OS/c1-2-3-12-22-19(25)14-23-20(26)24(15-17-8-5-4-6-9-17)16-18-10-7-11-21-13-18/h4-11,13H,2-3,12,14-16H2,1H3,(H,22,25)(H,23,26)