3-(3-fluorophenyl)-1-(3-methylbutyl)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 3-(3-fluorophenyl)-1-(3-methylbutyl)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea Openeye Name: 3-(3-fluorophenyl)-1-isopentyl-1-(1-isopropylpiperidin-1-ium-4-yl)thiourea CAS Name: 3-(3-fluorophenyl)-1-(3-methylbutyl)-1-(1-propan-2-yl-4-piperidin-1-iumyl)thiourea IUPAC Name: 3-(3-fluorophenyl)-1-(3-methylbutyl)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea Traditional Name: 3-(3-fluorophenyl)-1-isoamyl-1-(1-isopropylpiperidin-1-ium-4-yl)thiourea Formula: C20H33FN3S+ MolecularWeight: 366.559523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C1CC[NH+](CC1)C(C)C)C(=S)NC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)CCN(C1CC[NH+](CC1)C(C)C)C(=S)NC2=CC(=CC=C2)F

InChI

InChI=1S/C20H32FN3S/c1-15(2)8-13-24(19-9-11-23(12-10-19)16(3)4)20(25)22-18-7-5-6-17(21)14-18/h5-7,14-16,19H,8-13H2,1-4H3,(H,22,25)/p+1