1-tert-butyl-3-(2-phenylsulfanylethanoylamino)thiourea

Systemtic Name: 1-tert-butyl-3-(2-phenylsulfanylethanoylamino)thiourea Openeye Name: 1-tert-butyl-3-[(2-phenylsulfanylacetyl)amino]thiourea CAS Name: 1-tert-butyl-3-[[1-oxo-2-(phenylthio)ethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(2-phenylsulfanylacetyl)amino]thiourea Traditional Name: 1-tert-butyl-3-[[2-(phenylthio)acetyl]amino]thiourea Formula: C13H19N3OS2 MolecularWeight: 297.43946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)CSC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C13H19N3OS2/c1-13(2,3)14-12(18)16-15-11(17)9-19-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,15,17)(H2,14,16,18)