1-tert-butyl-3-[(4-methylsulfonylphenyl)carbonylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[(4-methylsulfonylphenyl)carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[(4-methylsulfonylbenzoyl)amino]thiourea CAS Name: 1-tert-butyl-3-[[(4-methylsulfonylphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(4-methylsulfonylbenzoyl)amino]thiourea Traditional Name: 1-tert-butyl-3-[(4-mesylbenzoyl)amino]thiourea Formula: C13H19N3O3S2 MolecularWeight: 329.43826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C13H19N3O3S2/c1-13(2,3)14-12(20)16-15-11(17)9-5-7-10(8-6-9)21(4,18)19/h5-8H,1-4H3,(H,15,17)(H2,14,16,20)