1-(2,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea Openeye Name: 1-(2,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-(2,5-dimethylphenyl)-3-(1-propyl-4-piperidin-1-iumyl)thiourea IUPAC Name: 1-(2,5-dimethylphenyl)-3-(1-propylpiperidin-1-ium-4-yl)thiourea Traditional Name: 1-(2,5-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=C(C=CC(=C2)C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3S/c1-4-9-20-10-7-15(8-11-20)18-17(21)19-16-12-13(2)5-6-14(16)3/h5-6,12,15H,4,7-11H2,1-3H3,(H2,18,19,21)/p+1