1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-piperidin-1-ylphenyl)ethylideneamino]thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-piperidin-1-ylphenyl)ethylideneamino]thiourea Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-[4-(1-piperidyl)phenyl]ethylideneamino]thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-[(Z)-1-[4-(1-piperidinyl)phenyl]ethylideneamino]thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-piperidin-1-ylphenyl)ethylideneamino]thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-piperidinophenyl)ethylideneamino]thiourea Formula: C21H34N5OS+ MolecularWeight: 404.59256

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCCC[NH+]1CCOCC1)C2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

C/C(=N/NC(=S)NCCC[NH+]1CCOCC1)/C2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C21H33N5OS/c1-18(19-6-8-20(9-7-19)26-12-3-2-4-13-26)23-24-21(28)22-10-5-11-25-14-16-27-17-15-25/h6-9H,2-5,10-17H2,1H3,(H2,22,24,28)/p+1/b23-18-