1-[(2-dodecylphenyl)sulfonylamino]-3-(2,4,4-trimethylpentan-2-yl)thiourea

Systemtic Name: 1-[(2-dodecylphenyl)sulfonylamino]-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-[(2-dodecylphenyl)sulfonylamino]-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-[(2-dodecylphenyl)sulfonylamino]-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-[(2-dodecylphenyl)sulfonylamino]-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-[(2-laurylphenyl)sulfonylamino]-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C27H49N3O2S2 MolecularWeight: 511.82686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)NNC(=S)NC(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)NNC(=S)NC(C)(C)CC(C)(C)C

InChI

InChI=1S/C27H49N3O2S2/c1-7-8-9-10-11-12-13-14-15-16-19-23-20-17-18-21-24(23)34(31,32)30-29-25(33)28-27(5,6)22-26(2,3)4/h17-18,20-21,30H,7-16,19,22H2,1-6H3,(H2,28,29,33)