1-[(4-tert-butylphenyl)sulfonylamino]-3-[(1R,2R,3S)-2,3-dimethylcyclohexyl]thiourea

Systemtic Name: 1-[(4-tert-butylphenyl)sulfonylamino]-3-[(1R,2R,3S)-2,3-dimethylcyclohexyl]thiourea Openeye Name: 1-[(4-tert-butylphenyl)sulfonylamino]-3-[(1R,2R,3S)-2,3-dimethylcyclohexyl]thiourea CAS Name: 1-[(4-tert-butylphenyl)sulfonylamino]-3-[(1R,2R,3S)-2,3-dimethylcyclohexyl]thiourea IUPAC Name: 1-[(4-tert-butylphenyl)sulfonylamino]-3-[(1R,2R,3S)-2,3-dimethylcyclohexyl]thiourea Traditional Name: 1-[(4-tert-butylphenyl)sulfonylamino]-3-[(1R,2R,3S)-2,3-dimethylcyclohexyl]thiourea Formula: C19H31N3O2S2 MolecularWeight: 397.59834

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=S)NNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@H]1CCC[C@H]([C@@H]1C)NC(=S)NNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C19H31N3O2S2/c1-13-7-6-8-17(14(13)2)20-18(25)21-22-26(23,24)16-11-9-15(10-12-16)19(3,4)5/h9-14,17,22H,6-8H2,1-5H3,(H2,20,21,25)/t13-,14+,17+/m0/s1