ethyl N-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylcarbamothioylamino]carbamate

Systemtic Name: ethyl N-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylcarbamothioylamino]carbamate Openeye Name: ethyl N-[3-(4-morpholinosulfonylphenyl)propanoylcarbamothioylamino]carbamate CAS Name: N-[[[[3-[4-(4-morpholinylsulfonyl)phenyl]-1-oxopropyl]amino]-sulfanylidenemethyl]amino]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylcarbamothioylamino]carbamate Traditional Name: N-[3-(4-morpholinosulfonylphenyl)propanoylthiocarbamoylamino]carbamic acid ethyl ester Formula: C17H24N4O6S2 MolecularWeight: 444.52566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NNC(=S)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CCOC(=O)NNC(=S)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H24N4O6S2/c1-2-27-17(23)20-19-16(28)18-15(22)8-5-13-3-6-14(7-4-13)29(24,25)21-9-11-26-12-10-21/h3-4,6-7H,2,5,8-12H2,1H3,(H,20,23)(H2,18,19,22,28)