N-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)amino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)amino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[(4-anilino-4-oxo-butanoyl)amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[(4-anilino-1,4-dioxobutyl)hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[(4-anilino-4-oxobutanoyl)amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[(4-anilino-4-keto-butanoyl)amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NNC(=O)CCC(=O)NC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NNC(=O)CCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H24N4O3S/c23-15(19-14-9-5-2-6-10-14)11-12-16(24)21-22-18(26)20-17(25)13-7-3-1-4-8-13/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2,(H,19,23)(H,21,24)(H2,20,22,25,26)