1-[[2-(diethylsulfamoyl)-4-nitro-phenyl]amino]-3-(3-ethoxypropyl)thiourea

Systemtic Name: 1-[[2-(diethylsulfamoyl)-4-nitro-phenyl]amino]-3-(3-ethoxypropyl)thiourea Openeye Name: 1-[2-(diethylsulfamoyl)-4-nitro-anilino]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-[2-(diethylsulfamoyl)-4-nitro-anilino]-3-(3-ethoxypropyl)thiourea Formula: C16H27N5O5S2 MolecularWeight: 433.54608

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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)NCCCOCC

Isomeric SMILES

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

InChI

InChI=1S/C16H27N5O5S2/c1-4-20(5-2)28(24,25)15-12-13(21(22)23)8-9-14(15)18-19-16(27)17-10-7-11-26-6-3/h8-9,12,18H,4-7,10-11H2,1-3H3,(H2,17,19,27)