4-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)piperazine-1-carbothioamide Openeye Name: 4-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)piperazine-1-carbothioamide CAS Name: 4-(3-chlorophenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-1-piperazinecarbothioamide IUPAC Name: 4-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)piperazine-1-carbothioamide Traditional Name: 4-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)piperazine-1-carbothioamide Formula: C17H26ClN4OS+ MolecularWeight: 369.93254

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H25ClN4OS/c18-15-2-1-3-16(14-15)21-6-8-22(9-7-21)17(24)19-4-5-20-10-12-23-13-11-20/h1-3,14H,4-13H2,(H,19,24)/p+1