ethyl 4-[methyl-[(2-nitrophenyl)carbamothioyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[methyl-[(2-nitrophenyl)carbamothioyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[methyl-[(2-nitrophenyl)carbamothioyl]amino]piperidine-1-carboxylate CAS Name: 4-[methyl-[(2-nitroanilino)-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[methyl-[(2-nitrophenyl)carbamothioyl]amino]piperidine-1-carboxylate Traditional Name: 4-[methyl-[(2-nitrophenyl)thiocarbamoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C16H22N4O4S MolecularWeight: 366.43528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N(C)C(=S)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N(C)C(=S)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O4S/c1-3-24-16(21)19-10-8-12(9-11-19)18(2)15(25)17-13-6-4-5-7-14(13)20(22)23/h4-7,12H,3,8-11H2,1-2H3,(H,17,25)