1-[(1R)-1-phenylethyl]-3-(2-piperidin-1-ium-1-ylethyl)thiourea

Systemtic Name: 1-[(1R)-1-phenylethyl]-3-(2-piperidin-1-ium-1-ylethyl)thiourea Openeye Name: 1-[(1R)-1-phenylethyl]-3-(2-piperidin-1-ium-1-ylethyl)thiourea CAS Name: 1-[(1R)-1-phenylethyl]-3-[2-(1-piperidin-1-iumyl)ethyl]thiourea IUPAC Name: 1-[(1R)-1-phenylethyl]-3-(2-piperidin-1-ium-1-ylethyl)thiourea Traditional Name: 1-[(1R)-1-phenylethyl]-3-(2-piperidin-1-ium-1-ylethyl)thiourea Formula: C16H26N3S+ MolecularWeight: 292.46274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)NCC[NH+]2CCCCC2

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=S)NCC[NH+]2CCCCC2

InChI

InChI=1S/C16H25N3S/c1-14(15-8-4-2-5-9-15)18-16(20)17-10-13-19-11-6-3-7-12-19/h2,4-5,8-9,14H,3,6-7,10-13H2,1H3,(H2,17,18,20)/p+1/t14-/m1/s1