1-(3-morpholin-4-ium-4-ylpropyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(2-phenyl-3,4-dihydropyrazol-5-yl)thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(1-phenyl-2-pyrazolin-3-yl)thiourea Formula: C17H26N5OS+ MolecularWeight: 348.48624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1NC(=S)NCCC[NH+]2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

C1CN(N=C1NC(=S)NCCC[NH+]2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H25N5OS/c24-17(18-8-4-9-21-11-13-23-14-12-21)19-16-7-10-22(20-16)15-5-2-1-3-6-15/h1-3,5-6H,4,7-14H2,(H2,18,19,20,24)/p+1