1-(1-adamantyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-(1-adamantyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(1-adamantyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(1-adamantyl)-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(1-adamantyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(1-adamantyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C17H30N3OS+ MolecularWeight: 324.5046

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H29N3OS/c22-16(18-1-2-20-3-5-21-6-4-20)19-17-10-13-7-14(11-17)9-15(8-13)12-17/h13-15H,1-12H2,(H2,18,19,22)/p+1