ethyl N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylcarbamothioylamino]carbamate

Systemtic Name: ethyl N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylcarbamothioylamino]carbamate Openeye Name: ethyl N-[(4-pyrrolidin-1-ylsulfonylbenzoyl)carbamothioylamino]carbamate CAS Name: N-[[[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]-sulfanylidenemethyl]amino]carbamic acid ethyl ester IUPAC Name: ethyl N-[(4-pyrrolidin-1-ylsulfonylbenzoyl)carbamothioylamino]carbamate Traditional Name: N-[(4-pyrrolidinosulfonylbenzoyl)thiocarbamoylamino]carbamic acid ethyl ester Formula: C15H20N4O5S2 MolecularWeight: 400.4731

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NNC(=S)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CCOC(=O)NNC(=S)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C15H20N4O5S2/c1-2-24-15(21)18-17-14(25)16-13(20)11-5-7-12(8-6-11)26(22,23)19-9-3-4-10-19/h5-8H,2-4,9-10H2,1H3,(H,18,21)(H2,16,17,20,25)