N-[[[4-(2-methylpropanoylamino)phenyl]carbonylamino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[[4-(2-methylpropanoylamino)phenyl]carbonylamino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[[4-(2-methylpropanoylamino)benzoyl]amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[[4-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[[4-(2-methylpropanoylamino)benzoyl]amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[[4-(isobutyrylamino)benzoyl]amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4O3S/c1-12(2)16(24)20-15-10-8-14(9-11-15)18(26)22-23-19(27)21-17(25)13-6-4-3-5-7-13/h8-13H,3-7H2,1-2H3,(H,20,24)(H,22,26)(H2,21,23,25,27)