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

Systemtic Name: 1-(5-chloranyl-2-cyano-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(5-chloro-2-cyano-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(5-chloro-2-cyanophenyl)-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(5-chloro-2-cyanophenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(5-chloro-2-cyano-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C14H18ClN4OS+ MolecularWeight: 325.83692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClN4OS/c15-12-2-1-11(10-16)13(9-12)18-14(21)17-3-4-19-5-7-20-8-6-19/h1-2,9H,3-8H2,(H2,17,18,21)/p+1