2-(2-thiophen-2-ylethanoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(2-thiophen-2-ylethanoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[[2-(2-thienyl)acetyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[(1-oxo-2-thiophen-2-ylethyl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(2-thiophen-2-ylacetyl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-mesityl-2-[[2-(2-thienyl)acetyl]amino]-1,3-benzothiazole-6-carboxamide Formula: C23H21N3O2S2 MolecularWeight: 435.56174

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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)CC4=CC=CS4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CC4=CC=CS4)C

InChI

InChI=1S/C23H21N3O2S2/c1-13-9-14(2)21(15(3)10-13)26-22(28)16-6-7-18-19(11-16)30-23(24-18)25-20(27)12-17-5-4-8-29-17/h4-11H,12H2,1-3H3,(H,26,28)(H,24,25,27)