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

Systemtic Name: 1-tert-butyl-3-(2-phenylsulfanylethyl)thiourea Openeye Name: 1-tert-butyl-3-(2-phenylsulfanylethyl)thiourea CAS Name: 1-tert-butyl-3-[2-(phenylthio)ethyl]thiourea IUPAC Name: 1-tert-butyl-3-(2-phenylsulfanylethyl)thiourea Traditional Name: 1-tert-butyl-3-[2-(phenylthio)ethyl]thiourea Formula: C13H20N2S2 MolecularWeight: 268.4413

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NCCSC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)NC(=S)NCCSC1=CC=CC=C1

InChI

InChI=1S/C13H20N2S2/c1-13(2,3)15-12(16)14-9-10-17-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H2,14,15,16)