1-(2-hexadecylsulfanylphenyl)thiourea

Systemtic Name: 1-(2-hexadecylsulfanylphenyl)thiourea Openeye Name: (2-hexadecylsulfanylphenyl)thiourea CAS Name: [2-(hexadecylthio)phenyl]thiourea IUPAC Name: (2-hexadecylsulfanylphenyl)thiourea Traditional Name: [2-(cetylthio)phenyl]thiourea Formula: C23H40N2S2 MolecularWeight: 408.7071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1=CC=CC=C1NC(=S)N

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1=CC=CC=C1NC(=S)N

InChI

InChI=1S/C23H40N2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-27-22-19-16-15-18-21(22)25-23(24)26/h15-16,18-19H,2-14,17,20H2,1H3,(H3,24,25,26)