2-(2-sulfanylideneimidazolidin-1-yl)ethyl N-[(2-pyrrol-1-ylphenyl)carbonylamino]carbamate

Systemtic Name: 2-(2-sulfanylideneimidazolidin-1-yl)ethyl N-[(2-pyrrol-1-ylphenyl)carbonylamino]carbamate Openeye Name: 2-(2-thioxoimidazolidin-1-yl)ethyl N-[(2-pyrrol-1-ylbenzoyl)amino]carbamate CAS Name: N-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]amino]carbamic acid 2-(2-sulfanylidene-1-imidazolidinyl)ethyl ester IUPAC Name: 2-(2-sulfanylideneimidazolidin-1-yl)ethyl N-[(2-pyrrol-1-ylbenzoyl)amino]carbamate Traditional Name: N-[(2-pyrrol-1-ylbenzoyl)amino]carbamic acid 2-(2-thioxoimidazolidin-1-yl)ethyl ester Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=S)N1)CCOC(=O)NNC(=O)C2=CC=CC=C2N3C=CC=C3

Isomeric SMILES

C1CN(C(=S)N1)CCOC(=O)NNC(=O)C2=CC=CC=C2N3C=CC=C3

InChI

InChI=1S/C17H19N5O3S/c23-15(13-5-1-2-6-14(13)21-8-3-4-9-21)19-20-17(24)25-12-11-22-10-7-18-16(22)26/h1-6,8-9H,7,10-12H2,(H,18,26)(H,19,23)(H,20,24)