1-(phenylmethyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea

Systemtic Name: 1-(phenylmethyl)-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Openeye Name: 1-benzyl-3-(3-piperidin-1-ium-1-ylpropyl)thiourea CAS Name: 1-(phenylmethyl)-3-[3-(1-piperidin-1-iumyl)propyl]thiourea IUPAC Name: 1-benzyl-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Traditional Name: 1-benzyl-3-(3-piperidin-1-ium-1-ylpropyl)thiourea Formula: C16H26N3S+ MolecularWeight: 292.46274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=S)NCC2=CC=CC=C2

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C16H25N3S/c20-16(18-14-15-8-3-1-4-9-15)17-10-7-13-19-11-5-2-6-12-19/h1,3-4,8-9H,2,5-7,10-14H2,(H2,17,18,20)/p+1