1-(5-chloranyl-2-methyl-phenyl)-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-[(2-benzylsulfanylacetyl)amino]-3-(5-chloro-2-methyl-phenyl)thiourea CAS Name: 1-(5-chloro-2-methylphenyl)-3-[[1-oxo-2-(phenylmethylthio)ethyl]amino]thiourea IUPAC Name: 1-[(2-benzylsulfanylacetyl)amino]-3-(5-chloro-2-methylphenyl)thiourea Traditional Name: 1-[[2-(benzylthio)acetyl]amino]-3-(5-chloro-2-methyl-phenyl)thiourea Formula: C17H18ClN3OS2 MolecularWeight: 379.92732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)NNC(=O)CSCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)NNC(=O)CSCC2=CC=CC=C2

InChI

InChI=1S/C17H18ClN3OS2/c1-12-7-8-14(18)9-15(12)19-17(23)21-20-16(22)11-24-10-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,20,22)(H2,19,21,23)