1-[[2-(diethylsulfamoyl)-4-nitro-phenyl]amino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[[2-(diethylsulfamoyl)-4-nitro-phenyl]amino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[2-(diethylsulfamoyl)-4-nitro-anilino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[2-(diethylsulfamoyl)-4-nitro-anilino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C16H25N5O5S2 MolecularWeight: 431.5302

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NNC(=S)NCC2CCCO2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NNC(=S)NC[C@H]2CCCO2

InChI

InChI=1S/C16H25N5O5S2/c1-3-20(4-2)28(24,25)15-10-12(21(22)23)7-8-14(15)18-19-16(27)17-11-13-6-5-9-26-13/h7-8,10,13,18H,3-6,9,11H2,1-2H3,(H2,17,19,27)/t13-/m1/s1