ethyl N-[(1-methyl-4-nitro-pyrrol-3-yl)carbamothioyl]carbamate

Systemtic Name: ethyl N-[(1-methyl-4-nitro-pyrrol-3-yl)carbamothioyl]carbamate Openeye Name: ethyl N-[(1-methyl-4-nitro-pyrrol-3-yl)carbamothioyl]carbamate CAS Name: N-[[(1-methyl-4-nitro-3-pyrrolyl)amino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(1-methyl-4-nitropyrrol-3-yl)carbamothioyl]carbamate Traditional Name: N-[(1-methyl-4-nitro-pyrrol-3-yl)thiocarbamoyl]carbamic acid ethyl ester Formula: C9H12N4O4S MolecularWeight: 272.28098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NC1=CN(C=C1[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)NC(=S)NC1=CN(C=C1[N+](=O)[O-])C

InChI

InChI=1S/C9H12N4O4S/c1-3-17-9(14)11-8(18)10-6-4-12(2)5-7(6)13(15)16/h4-5H,3H2,1-2H3,(H2,10,11,14,18)