2-[[3-morpholin-4-ylpropyl(thiophen-2-ylmethyl)carbamothioyl]amino]-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-[[3-morpholin-4-ylpropyl(thiophen-2-ylmethyl)carbamothioyl]amino]-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[[3-morpholinopropyl(2-thienylmethyl)carbamothioyl]amino]-N-(2-pyridylmethyl)acetamide CAS Name: 2-[[[3-(4-morpholinyl)propyl-(thiophen-2-ylmethyl)amino]-sulfanylidenemethyl]amino]-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-[[3-morpholin-4-ylpropyl(thiophen-2-ylmethyl)carbamothioyl]amino]-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[[3-morpholinopropyl(2-thenyl)thiocarbamoyl]amino]-N-(2-pyridylmethyl)acetamide Formula: C21H29N5O2S2 MolecularWeight: 447.61726

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(CC2=CC=CS2)C(=S)NCC(=O)NCC3=CC=CC=N3

Isomeric SMILES

C1COCCN1CCCN(CC2=CC=CS2)C(=S)NCC(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C21H29N5O2S2/c27-20(23-15-18-5-1-2-7-22-18)16-24-21(29)26(17-19-6-3-14-30-19)9-4-8-25-10-12-28-13-11-25/h1-3,5-7,14H,4,8-13,15-17H2,(H,23,27)(H,24,29)