N-[(3-acetamidophenyl)carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[(3-acetamidophenyl)carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[(3-acetamidophenyl)carbamothioyl]cyclohexanecarboxamide CAS Name: N-[(3-acetamidoanilino)-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[(3-acetamidophenyl)carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[(3-acetamidophenyl)thiocarbamoyl]cyclohexanecarboxamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2CCCCC2

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2CCCCC2

InChI

InChI=1S/C16H21N3O2S/c1-11(20)17-13-8-5-9-14(10-13)18-16(22)19-15(21)12-6-3-2-4-7-12/h5,8-10,12H,2-4,6-7H2,1H3,(H,17,20)(H2,18,19,21,22)