1-[[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitro-phenyl]amino]-3-(2-methylcyclohexyl)thiourea

Systemtic Name: 1-[[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitro-phenyl]amino]-3-(2-methylcyclohexyl)thiourea Openeye Name: 1-[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitro-anilino]-3-(2-methylcyclohexyl)thiourea CAS Name: 1-[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitroanilino]-3-(2-methylcyclohexyl)thiourea IUPAC Name: 1-[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitroanilino]-3-(2-methylcyclohexyl)thiourea Traditional Name: 1-[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitro-anilino]-3-(2-methylcyclohexyl)thiourea Formula: C22H29N5O4S2 MolecularWeight: 491.62676

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=C(C=C(C=C3)C)C

Isomeric SMILES

CC1CCCCC1NC(=S)NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C22H29N5O4S2/c1-14-8-10-19(16(3)12-14)26-33(30,31)21-13-17(27(28)29)9-11-20(21)24-25-22(32)23-18-7-5-4-6-15(18)2/h8-13,15,18,24,26H,4-7H2,1-3H3,(H2,23,25,32)