1-[2,3-bis(chloranyl)phenyl]-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]thiourea

Systemtic Name: 1-[2,3-bis(chloranyl)phenyl]-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]thiourea Openeye Name: 1-(2,3-dichlorophenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]thiourea CAS Name: 1-(2,3-dichlorophenyl)-3-[4-(1-piperidin-1-iumylmethyl)phenyl]thiourea IUPAC Name: 1-(2,3-dichlorophenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]thiourea Traditional Name: 1-(2,3-dichlorophenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]thiourea Formula: C19H22Cl2N3S+ MolecularWeight: 395.36908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=S)NC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=S)NC3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C19H21Cl2N3S/c20-16-5-4-6-17(18(16)21)23-19(25)22-15-9-7-14(8-10-15)13-24-11-2-1-3-12-24/h4-10H,1-3,11-13H2,(H2,22,23,25)/p+1