1-(2-morpholin-4-ium-4-ylethyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea Openeye Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]thiourea CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-3-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]thiourea IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)thiourea Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(5-morpholinosulfonyl-2-piperidino-phenyl)thiourea Formula: C22H36N5O4S2+ MolecularWeight: 498.68234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NCC[NH+]4CCOCC4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NCC[NH+]4CCOCC4

InChI

InChI=1S/C22H35N5O4S2/c28-33(29,27-12-16-31-17-13-27)19-4-5-21(26-7-2-1-3-8-26)20(18-19)24-22(32)23-6-9-25-10-14-30-15-11-25/h4-5,18H,1-3,6-17H2,(H2,23,24,32)/p+1