N-[(2-methyl-4-nitro-phenyl)carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[(2-methyl-4-nitro-phenyl)carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[(2-methyl-4-nitro-phenyl)carbamothioyl]cyclohexanecarboxamide CAS Name: N-[(2-methyl-4-nitroanilino)-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[(2-methyl-4-nitrophenyl)carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[(2-methyl-4-nitro-phenyl)thiocarbamoyl]cyclohexanecarboxamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2CCCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2CCCCC2

InChI

InChI=1S/C15H19N3O3S/c1-10-9-12(18(20)21)7-8-13(10)16-15(22)17-14(19)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H2,16,17,19,22)