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

Systemtic Name: 3-(4-chloranyl-3-methyl-phenyl)-1-propan-2-yl-1-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea Openeye Name: 3-(4-chloro-3-methyl-phenyl)-1-isopropyl-1-(1-isopropylpiperidin-1-ium-4-yl)thiourea CAS Name: 3-(4-chloro-3-methylphenyl)-1-propan-2-yl-1-(1-propan-2-yl-4-piperidin-1-iumyl)thiourea IUPAC Name: 3-(4-chloro-3-methylphenyl)-1-propan-2-yl-1-(1-propan-2-ylpiperidin-1-ium-4-yl)thiourea Traditional Name: 3-(4-chloro-3-methyl-phenyl)-1-isopropyl-1-(1-isopropylpiperidin-1-ium-4-yl)thiourea Formula: C19H31ClN3S+ MolecularWeight: 368.98754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)N(C2CC[NH+](CC2)C(C)C)C(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)N(C2CC[NH+](CC2)C(C)C)C(C)C)Cl

InChI

InChI=1S/C19H30ClN3S/c1-13(2)22-10-8-17(9-11-22)23(14(3)4)19(24)21-16-6-7-18(20)15(5)12-16/h6-7,12-14,17H,8-11H2,1-5H3,(H,21,24)/p+1