1-(4-bromanyl-3-methyl-phenyl)-3-[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]urea

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-3-[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]urea Openeye Name: 1-(4-bromo-3-methyl-phenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea CAS Name: 1-(4-bromo-3-methylphenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea IUPAC Name: 1-(4-bromo-3-methylphenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea Traditional Name: 1-(4-bromo-3-methyl-phenyl)-3-[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]urea Formula: C16H15BrN4O3S2 MolecularWeight: 455.3493

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN4O3S2/c1-9-7-10(3-5-12(9)17)18-15(22)19-11-4-6-13-14(8-11)25-16(20-13)21-26(2,23)24/h3-8H,1-2H3,(H,20,21)(H2,18,19,22)