1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(3-methoxypropyl)thiourea

Systemtic Name: 1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(3-methoxypropyl)thiourea Openeye Name: 1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(3-methoxypropyl)thiourea CAS Name: 1-[(2R)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]-3-(3-methoxypropyl)thiourea IUPAC Name: 1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]-3-(3-methoxypropyl)thiourea Traditional Name: 1-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(3-methoxypropyl)thiourea Formula: C19H32N3O2S+ MolecularWeight: 366.54128

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NCC(C1=CC=C(C=C1)OC)[NH+]2CCCCC2

Isomeric SMILES

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

InChI

InChI=1S/C19H31N3O2S/c1-23-14-6-11-20-19(25)21-15-18(22-12-4-3-5-13-22)16-7-9-17(24-2)10-8-16/h7-10,18H,3-6,11-15H2,1-2H3,(H2,20,21,25)/p+1/t18-/m0/s1