1-dodecyl-3-[4-[4-(dodecylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea

Systemtic Name: 1-dodecyl-3-[4-[4-(dodecylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea Openeye Name: 1-dodecyl-3-[4-[4-(dodecylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea CAS Name: 1-dodecyl-3-[4-[4-[[(dodecylamino)-sulfanylidenemethyl]amino]phenyl]sulfonylphenyl]thiourea IUPAC Name: 1-dodecyl-3-[4-[4-(dodecylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea Traditional Name: 1-lauryl-3-[4-[4-(laurylthiocarbamoylamino)phenyl]sulfonylphenyl]thiourea Formula: C38H62N4O2S3 MolecularWeight: 703.11948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCCCCCCCCCCC

InChI

InChI=1S/C38H62N4O2S3/c1-3-5-7-9-11-13-15-17-19-21-31-39-37(45)41-33-23-27-35(28-24-33)47(43,44)36-29-25-34(26-30-36)42-38(46)40-32-22-20-18-16-14-12-10-8-6-4-2/h23-30H,3-22,31-32H2,1-2H3,(H2,39,41,45)(H2,40,42,46)