1-(2-ethylphenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea

Systemtic Name: 1-(2-ethylphenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Openeye Name: 1-(2-ethylphenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea CAS Name: 1-(2-ethylphenyl)-3-[3-(1-piperidin-1-iumyl)propyl]thiourea IUPAC Name: 1-(2-ethylphenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Traditional Name: 1-(2-ethylphenyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Formula: C17H28N3S+ MolecularWeight: 306.48932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NCCC[NH+]2CCCCC2

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NCCC[NH+]2CCCCC2

InChI

InChI=1S/C17H27N3S/c1-2-15-9-4-5-10-16(15)19-17(21)18-11-8-14-20-12-6-3-7-13-20/h4-5,9-10H,2-3,6-8,11-14H2,1H3,(H2,18,19,21)/p+1