1-(5-chloranyl-2-phenylsulfanyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-(5-chloranyl-2-phenylsulfanyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(5-chloro-2-phenylsulfanyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[5-chloro-2-(phenylthio)phenyl]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(5-chloro-2-phenylsulfanylphenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[5-chloro-2-(phenylthio)phenyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C19H23ClN3OS2+ MolecularWeight: 408.98842

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NC2=C(C=CC(=C2)Cl)SC3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NC2=C(C=CC(=C2)Cl)SC3=CC=CC=C3

InChI

InChI=1S/C19H22ClN3OS2/c20-15-6-7-18(26-16-4-2-1-3-5-16)17(14-15)22-19(25)21-8-9-23-10-12-24-13-11-23/h1-7,14H,8-13H2,(H2,21,22,25)/p+1