1-(4-chlorophenyl)-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiourea CAS Name: 1-(4-chlorophenyl)-3-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]thiourea Formula: C19H23ClN3S+ MolecularWeight: 360.92402

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3S/c20-17-7-9-18(10-8-17)22-19(24)21-13-15-3-5-16(6-4-15)14-23-11-1-2-12-23/h3-10H,1-2,11-14H2,(H2,21,22,24)/p+1