2-[(2-bromanyl-5-methoxy-phenyl)carbamoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-[(2-bromanyl-5-methoxy-phenyl)carbamoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[(2-bromo-5-methoxy-phenyl)carbamoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[(2-bromo-5-methoxyanilino)-oxomethyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(2-bromo-5-methoxyphenyl)carbamoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[(2-bromo-5-methoxy-phenyl)carbamoylamino]-N-mesityl-1,3-benzothiazole-6-carboxamide Formula: C25H23BrN4O3S MolecularWeight: 539.44412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NC4=C(C=CC(=C4)OC)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NC4=C(C=CC(=C4)OC)Br)C

InChI

InChI=1S/C25H23BrN4O3S/c1-13-9-14(2)22(15(3)10-13)29-23(31)16-5-8-19-21(11-16)34-25(28-19)30-24(32)27-20-12-17(33-4)6-7-18(20)26/h5-12H,1-4H3,(H,29,31)(H2,27,28,30,32)