2-chloranyl-5-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-cyclohexyl-benzamide

Systemtic Name: 2-chloranyl-5-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-cyclohexyl-benzamide Openeye Name: 2-chloro-5-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-cyclohexyl-benzamide CAS Name: 2-chloro-5-[[[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-cyclohexylbenzamide IUPAC Name: 2-chloro-5-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-cyclohexylbenzamide Traditional Name: 2-chloro-5-[[(E)-3-(4-chlorophenyl)acryloyl]thiocarbamoylamino]-N-cyclohexyl-benzamide Formula: C23H23Cl2N3O2S MolecularWeight: 476.41862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23Cl2N3O2S/c24-16-9-6-15(7-10-16)8-13-21(29)28-23(31)27-18-11-12-20(25)19(14-18)22(30)26-17-4-2-1-3-5-17/h6-14,17H,1-5H2,(H,26,30)(H2,27,28,29,31)/b13-8+