1-butyl-3-[(3-nitrophenyl)sulfonylamino]thiourea

Systemtic Name: 1-butyl-3-[(3-nitrophenyl)sulfonylamino]thiourea Openeye Name: 1-butyl-3-[(3-nitrophenyl)sulfonylamino]thiourea CAS Name: 1-butyl-3-[(3-nitrophenyl)sulfonylamino]thiourea IUPAC Name: 1-butyl-3-[(3-nitrophenyl)sulfonylamino]thiourea Traditional Name: 1-butyl-3-[(3-nitrophenyl)sulfonylamino]thiourea Formula: C11H16N4O4S2 MolecularWeight: 332.39914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNS(=O)(=O)C1=CC=CC(=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=S)NNS(=O)(=O)C1=CC=CC(=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H16N4O4S2/c1-2-3-7-12-11(20)13-14-21(18,19)10-6-4-5-9(8-10)15(16)17/h4-6,8,14H,2-3,7H2,1H3,(H2,12,13,20)