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

Systemtic Name: N-(2-diethylaminoethyl)-2-[[3-morpholin-4-ylpropyl(thiophen-2-ylmethyl)carbamothioyl]amino]ethanamide Openeye Name: N-(2-diethylaminoethyl)-2-[[3-morpholinopropyl(2-thienylmethyl)carbamothioyl]amino]acetamide CAS Name: N-(2-diethylaminoethyl)-2-[[[3-(4-morpholinyl)propyl-(thiophen-2-ylmethyl)amino]-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(2-diethylaminoethyl)-2-[[3-morpholin-4-ylpropyl(thiophen-2-ylmethyl)carbamothioyl]amino]acetamide Traditional Name: N-(2-diethylaminoethyl)-2-[[3-morpholinopropyl(2-thenyl)thiocarbamoyl]amino]acetamide Formula: C21H37N5O2S2 MolecularWeight: 455.68078

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)CNC(=S)N(CCCN1CCOCC1)CC2=CC=CS2

Isomeric SMILES

CCN(CC)CCNC(=O)CNC(=S)N(CCCN1CCOCC1)CC2=CC=CS2

InChI

InChI=1S/C21H37N5O2S2/c1-3-24(4-2)11-8-22-20(27)17-23-21(29)26(18-19-7-5-16-30-19)10-6-9-25-12-14-28-15-13-25/h5,7,16H,3-4,6,8-15,17-18H2,1-2H3,(H,22,27)(H,23,29)