1-(4-hexadecylsulfonylphenyl)thiourea

Systemtic Name: 1-(4-hexadecylsulfonylphenyl)thiourea Openeye Name: (4-hexadecylsulfonylphenyl)thiourea CAS Name: (4-hexadecylsulfonylphenyl)thiourea IUPAC Name: (4-hexadecylsulfonylphenyl)thiourea Traditional Name: (4-cetylsulfonylphenyl)thiourea Formula: C23H40N2O2S2 MolecularWeight: 440.7059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)C1=CC=C(C=C1)NC(=S)N

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)C1=CC=C(C=C1)NC(=S)N

InChI

InChI=1S/C23H40N2O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-29(26,27)22-18-16-21(17-19-22)25-23(24)28/h16-19H,2-15,20H2,1H3,(H3,24,25,28)