1-methyl-3-[2-(2-phenoxyethylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-methyl-3-[2-(2-phenoxyethylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-methyl-3-[[2-(2-phenoxyethylsulfanyl)acetyl]amino]thiourea CAS Name: 1-methyl-3-[[1-oxo-2-(2-phenoxyethylthio)ethyl]amino]thiourea IUPAC Name: 1-methyl-3-[[2-(2-phenoxyethylsulfanyl)acetyl]amino]thiourea Traditional Name: 1-methyl-3-[[2-(2-phenoxyethylthio)acetyl]amino]thiourea Formula: C12H17N3O2S2 MolecularWeight: 299.41228

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)CSCCOC1=CC=CC=C1

Isomeric SMILES

CNC(=S)NNC(=O)CSCCOC1=CC=CC=C1

InChI

InChI=1S/C12H17N3O2S2/c1-13-12(18)15-14-11(16)9-19-8-7-17-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,14,16)(H2,13,15,18)