2-(pyridin-2-ylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(pyridin-2-ylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(2-pyridylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[oxo-(2-pyridinylamino)methyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(pyridin-2-ylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-mesityl-2-(2-pyridylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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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=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NC4=CC=CC=N4)C

InChI

InChI=1S/C23H21N5O2S/c1-13-10-14(2)20(15(3)11-13)27-21(29)16-7-8-17-18(12-16)31-23(25-17)28-22(30)26-19-6-4-5-9-24-19/h4-12H,1-3H3,(H,27,29)(H2,24,25,26,28,30)