N-(3-morpholin-4-ium-4-ylpropyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide Openeye Name: 4-benzoyl-N-(3-morpholin-4-ium-4-ylpropyl)piperazine-1-carbothioamide CAS Name: 4-benzoyl-N-[3-(4-morpholin-4-iumyl)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-benzoyl-N-(3-morpholin-4-ium-4-ylpropyl)piperazine-1-carbothioamide Traditional Name: 4-benzoyl-N-(3-morpholin-4-ium-4-ylpropyl)piperazine-1-carbothioamide Formula: C19H29N4O2S+ MolecularWeight: 377.52416

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=S)N2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCCNC(=S)N2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H28N4O2S/c24-18(17-5-2-1-3-6-17)22-9-11-23(12-10-22)19(26)20-7-4-8-21-13-15-25-16-14-21/h1-3,5-6H,4,7-16H2,(H,20,26)/p+1