2-chloranyl-N-cyclohexyl-5-(phenylcarbonylcarbamothioylamino)benzamide

Systemtic Name: 2-chloranyl-N-cyclohexyl-5-(phenylcarbonylcarbamothioylamino)benzamide Openeye Name: 5-(benzoylcarbamothioylamino)-2-chloro-N-cyclohexyl-benzamide CAS Name: 5-[[benzamido(sulfanylidene)methyl]amino]-2-chloro-N-cyclohexylbenzamide IUPAC Name: 5-(benzoylcarbamothioylamino)-2-chloro-N-cyclohexylbenzamide Traditional Name: 5-(benzoylthiocarbamoylamino)-2-chloro-N-cyclohexyl-benzamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H22ClN3O2S/c22-18-12-11-16(13-17(18)20(27)23-15-9-5-2-6-10-15)24-21(28)25-19(26)14-7-3-1-4-8-14/h1,3-4,7-8,11-13,15H,2,5-6,9-10H2,(H,23,27)(H2,24,25,26,28)