4-(cyclohexylcarbamothioylamino)-N-[(E)-(2,4-dichlorophenyl)methylideneamino]benzamide

Systemtic Name: 4-(cyclohexylcarbamothioylamino)-N-[(E)-(2,4-dichlorophenyl)methylideneamino]benzamide Openeye Name: 4-(cyclohexylcarbamothioylamino)-N-[(E)-(2,4-dichlorophenyl)methyleneamino]benzamide CAS Name: 4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-N-[(E)-(2,4-dichlorophenyl)methylideneamino]benzamide IUPAC Name: 4-(cyclohexylcarbamothioylamino)-N-[(E)-(2,4-dichlorophenyl)methylideneamino]benzamide Traditional Name: 4-(cyclohexylthiocarbamoylamino)-N-[(E)-(2,4-dichlorobenzylidene)amino]benzamide Formula: C21H22Cl2N4OS MolecularWeight: 449.39658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)NN=CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)N/N=C/C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H22Cl2N4OS/c22-16-9-6-15(19(23)12-16)13-24-27-20(28)14-7-10-18(11-8-14)26-21(29)25-17-4-2-1-3-5-17/h6-13,17H,1-5H2,(H,27,28)(H2,25,26,29)/b24-13+