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

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[2-[(2-methylphenyl)methylsulfanyl]ethanoylamino]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[[2-(o-tolylmethylsulfanyl)acetyl]amino]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[[2-[(2-methylphenyl)methylthio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[[2-[(2-methylphenyl)methylsulfanyl]acetyl]amino]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[[2-[(2-methylbenzyl)thio]acetyl]amino]thiourea Formula: C17H17BrClN3OS2 MolecularWeight: 458.82338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)NNC(=S)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)NNC(=S)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C17H17BrClN3OS2/c1-11-4-2-3-5-12(11)9-25-10-16(23)21-22-17(24)20-15-7-6-13(18)8-14(15)19/h2-8H,9-10H2,1H3,(H,21,23)(H2,20,22,24)