1-(4-bromanyl-2-chloranyl-phenyl)-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-[(2-benzylsulfanylacetyl)amino]-3-(4-bromo-2-chloro-phenyl)thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[[1-oxo-2-(phenylmethylthio)ethyl]amino]thiourea IUPAC Name: 1-[(2-benzylsulfanylacetyl)amino]-3-(4-bromo-2-chlorophenyl)thiourea Traditional Name: 1-[[2-(benzylthio)acetyl]amino]-3-(4-bromo-2-chloro-phenyl)thiourea Formula: C16H15BrClN3OS2 MolecularWeight: 444.7968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NNC(=S)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NNC(=S)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C16H15BrClN3OS2/c17-12-6-7-14(13(18)8-12)19-16(23)21-20-15(22)10-24-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,20,22)(H2,19,21,23)