1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-phenethyl-thiourea

Systemtic Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-phenethyl-thiourea Openeye Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-phenethyl-thiourea CAS Name: 1-methyl-1-(1-methyl-4-piperidin-1-iumyl)-3-phenethylthiourea IUPAC Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-phenethylthiourea Traditional Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-phenethyl-thiourea Formula: C16H26N3S+ MolecularWeight: 292.46274

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=S)NCCC2=CC=CC=C2

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C16H25N3S/c1-18-12-9-15(10-13-18)19(2)16(20)17-11-8-14-6-4-3-5-7-14/h3-7,15H,8-13H2,1-2H3,(H,17,20)/p+1