3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C17H24ClN4OS+ MolecularWeight: 367.91666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23ClN4OS/c18-15-3-5-16(6-4-15)20-17(24)22(9-1-7-19)10-2-8-21-11-13-23-14-12-21/h3-6H,1-2,8-14H2,(H,20,24)/p+1