1-(3,5-dimethylphenyl)-3-[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]urea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]urea Openeye Name: 1-(3,5-dimethylphenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea CAS Name: 1-(3,5-dimethylphenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea Traditional Name: 1-(3,5-dimethylphenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)NC2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)NC2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C)C

InChI

InChI=1S/C17H18N4O3S2/c1-10-6-11(2)8-13(7-10)19-16(22)18-12-4-5-14-15(9-12)25-17(20-14)21-26(3,23)24/h4-9H,1-3H3,(H,20,21)(H2,18,19,22)