1-(3,5-dimethylphenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea Openeye Name: 1-(3,5-dimethylphenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea CAS Name: 1-(3,5-dimethylphenyl)-3-[2-[5-(dimethylsulfamoyl)-1-benzotriazolyl]ethyl]urea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea Traditional Name: 1-(3,5-dimethylphenyl)-3-[2-[5-(dimethylsulfamoyl)benzotriazol-1-yl]ethyl]urea Formula: C19H24N6O3S MolecularWeight: 416.49726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)NCCN2C3=C(C=C(C=C3)S(=O)(=O)N(C)C)N=N2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)NCCN2C3=C(C=C(C=C3)S(=O)(=O)N(C)C)N=N2)C

InChI

InChI=1S/C19H24N6O3S/c1-13-9-14(2)11-15(10-13)21-19(26)20-7-8-25-18-6-5-16(12-17(18)22-23-25)29(27,28)24(3)4/h5-6,9-12H,7-8H2,1-4H3,(H2,20,21,26)