1-tert-butyl-3-[2-(phenylmethylsulfanyl)propanoylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[2-(phenylmethylsulfanyl)propanoylamino]thiourea Openeye Name: 1-(2-benzylsulfanylpropanoylamino)-3-tert-butyl-thiourea CAS Name: 1-tert-butyl-3-[[1-oxo-2-(phenylmethylthio)propyl]amino]thiourea IUPAC Name: 1-(2-benzylsulfanylpropanoylamino)-3-tert-butylthiourea Traditional Name: 1-[2-(benzylthio)propanoylamino]-3-tert-butyl-thiourea Formula: C15H23N3OS2 MolecularWeight: 325.49262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NC(C)(C)C)SCC1=CC=CC=C1

Isomeric SMILES

CC(C(=O)NNC(=S)NC(C)(C)C)SCC1=CC=CC=C1

InChI

InChI=1S/C15H23N3OS2/c1-11(21-10-12-8-6-5-7-9-12)13(19)17-18-14(20)16-15(2,3)4/h5-9,11H,10H2,1-4H3,(H,17,19)(H2,16,18,20)