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

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-pyridin-3-yl-thiourea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(3-pyridyl)thiourea CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-(3-pyridinyl)thiourea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-pyridin-3-ylthiourea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(3-pyridyl)thiourea Formula: C18H23N4S+ MolecularWeight: 327.46702

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=S)NC2=CN=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC(=S)NC2=CN=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H22N4S/c23-18(21-17-7-4-10-19-13-17)20-16-8-11-22(12-9-16)14-15-5-2-1-3-6-15/h1-7,10,13,16H,8-9,11-12,14H2,(H2,20,21,23)/p+1