1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-(1,3-dioxoisoindolin-2-yl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-(1,3-dioxo-2-isoindolyl)-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-(1,3-dioxoisoindol-2-yl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-phthalimido-thiourea Formula: C16H21N4O3S+ MolecularWeight: 349.42794

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=S)NN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1COCC[NH+]1CCCNC(=S)NN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H20N4O3S/c21-14-12-4-1-2-5-13(12)15(22)20(14)18-16(24)17-6-3-7-19-8-10-23-11-9-19/h1-2,4-5H,3,6-11H2,(H2,17,18,24)/p+1