1-(3-ethoxypropyl)-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]thiourea

Systemtic Name: 1-(3-ethoxypropyl)-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]thiourea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(3-ethoxypropyl)thiourea CAS Name: 1-(3-ethoxypropyl)-3-[1-(phenylmethyl)-4-piperidin-1-iumyl]thiourea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(3-ethoxypropyl)thiourea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(3-ethoxypropyl)thiourea Formula: C18H30N3OS+ MolecularWeight: 336.5153

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NC1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CCOCCCNC(=S)NC1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C18H29N3OS/c1-2-22-14-6-11-19-18(23)20-17-9-12-21(13-10-17)15-16-7-4-3-5-8-16/h3-5,7-8,17H,2,6,9-15H2,1H3,(H2,19,20,23)/p+1