1-[(2-nitro-4-sulfamoyl-phenyl)amino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[(2-nitro-4-sulfamoyl-phenyl)amino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-(2-nitro-4-sulfamoyl-anilino)thiourea CAS Name: 1-(2-nitro-4-sulfamoylanilino)-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-(2-nitro-4-sulfamoylanilino)-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-(2-nitro-4-sulfamoyl-anilino)-3-p-cumenyl-thiourea Formula: C16H19N5O4S2 MolecularWeight: 409.48316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O4S2/c1-10(2)11-3-5-12(6-4-11)18-16(26)20-19-14-8-7-13(27(17,24)25)9-15(14)21(22)23/h3-10,19H,1-2H3,(H2,17,24,25)(H2,18,20,26)