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

Systemtic Name: 1-[[2-(diethylsulfamoyl)-4-nitro-phenyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[2-(diethylsulfamoyl)-4-nitro-anilino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[2-(diethylsulfamoyl)-4-nitro-anilino]-3-p-anisyl-thiourea Formula: C19H25N5O5S2 MolecularWeight: 467.5623

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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)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NNC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H25N5O5S2/c1-4-23(5-2)31(27,28)18-12-15(24(25)26)8-11-17(18)21-22-19(30)20-13-14-6-9-16(29-3)10-7-14/h6-12,21H,4-5,13H2,1-3H3,(H2,20,22,30)