1-(3-bromophenyl)-3-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(3-bromophenyl)-3-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-(3-bromophenyl)-3-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]thiourea CAS Name: 1-(3-bromophenyl)-3-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-(3-bromophenyl)-3-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-(3-bromophenyl)-3-[2-(morpholin-4-ium-4-ylmethyl)benzyl]thiourea Formula: C19H23BrN3OS+ MolecularWeight: 421.37442

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=S)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=S)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H22BrN3OS/c20-17-6-3-7-18(12-17)22-19(25)21-13-15-4-1-2-5-16(15)14-23-8-10-24-11-9-23/h1-7,12H,8-11,13-14H2,(H2,21,22,25)/p+1