1-(2-azanyl-5-methylsulfonyl-phenyl)sulfonyl-3-butan-2-yl-thiourea

Systemtic Name: 1-(2-azanyl-5-methylsulfonyl-phenyl)sulfonyl-3-butan-2-yl-thiourea Openeye Name: 1-(2-amino-5-methylsulfonyl-phenyl)sulfonyl-3-sec-butyl-thiourea CAS Name: 1-(2-amino-5-methylsulfonylphenyl)sulfonyl-3-butan-2-ylthiourea IUPAC Name: 1-(2-amino-5-methylsulfonylphenyl)sulfonyl-3-butan-2-ylthiourea Traditional Name: 1-(2-amino-5-mesyl-phenyl)sulfonyl-3-sec-butyl-thiourea Formula: C12H19N3O4S3 MolecularWeight: 365.49196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)NS(=O)(=O)C1=C(C=CC(=C1)S(=O)(=O)C)N

Isomeric SMILES

CCC(C)NC(=S)NS(=O)(=O)C1=C(C=CC(=C1)S(=O)(=O)C)N

InChI

InChI=1S/C12H19N3O4S3/c1-4-8(2)14-12(20)15-22(18,19)11-7-9(21(3,16)17)5-6-10(11)13/h5-8H,4,13H2,1-3H3,(H2,14,15,20)