1-(3,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-(1-propyl-4-piperidin-1-iumyl)thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea Formula: C17H28N3S+ MolecularWeight: 306.48932

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=S)NC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=S)NC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C17H27N3S/c1-4-7-20-8-5-15(6-9-20)18-17(21)19-16-11-13(2)10-14(3)12-16/h10-12,15H,4-9H2,1-3H3,(H2,18,19,21)/p+1