1-[4-chloranyl-2-(phenylcarbonyl)phenyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[4-chloranyl-2-(phenylcarbonyl)phenyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(2-benzoyl-4-chloro-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(2-benzoyl-4-chlorophenyl)-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(2-benzoyl-4-chlorophenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(2-benzoyl-4-chloro-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C20H23ClN3O2S+ MolecularWeight: 404.93352

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22ClN3O2S/c21-16-6-7-18(17(14-16)19(25)15-4-2-1-3-5-15)23-20(27)22-8-9-24-10-12-26-13-11-24/h1-7,14H,8-13H2,(H2,22,23,27)/p+1