1-(4-bromanyl-2-chloranyl-phenyl)-3-[(2-oxidanyl-2,2-diphenyl-ethanoyl)amino]thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[(2-oxidanyl-2,2-diphenyl-ethanoyl)amino]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[(2-hydroxy-2,2-diphenyl-acetyl)amino]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[(2-hydroxy-1-oxo-2,2-diphenylethyl)amino]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[(2-hydroxy-2,2-diphenylacetyl)amino]thiourea Traditional Name: 1-(benziloylamino)-3-(4-bromo-2-chloro-phenyl)thiourea Formula: C21H17BrClN3O2S MolecularWeight: 490.80058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)NNC(=S)NC3=C(C=C(C=C3)Br)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)NNC(=S)NC3=C(C=C(C=C3)Br)Cl)O

InChI

InChI=1S/C21H17BrClN3O2S/c22-16-11-12-18(17(23)13-16)24-20(29)26-25-19(27)21(28,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,28H,(H,25,27)(H2,24,26,29)