1-(3-chloranyl-2-methyl-phenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-(1-isopropylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-(1-propan-2-yl-4-piperidin-1-iumyl)thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(1-isopropylpiperidin-1-ium-4-yl)thiourea Formula: C16H25ClN3S+ MolecularWeight: 326.9078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NC2CC[NH+](CC2)C(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NC2CC[NH+](CC2)C(C)C

InChI

InChI=1S/C16H24ClN3S/c1-11(2)20-9-7-13(8-10-20)18-16(21)19-15-6-4-5-14(17)12(15)3/h4-6,11,13H,7-10H2,1-3H3,(H2,18,19,21)/p+1