2-[2-(4-nitrophenyl)ethanoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-[2-(4-nitrophenyl)ethanoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[[2-(4-nitrophenyl)acetyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[2-(4-nitrophenyl)-1-oxoethyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[[2-(4-nitrophenyl)acetyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-mesityl-2-[[2-(4-nitrophenyl)acetyl]amino]-1,3-benzothiazole-6-carboxamide Formula: C25H22N4O4S MolecularWeight: 474.53158

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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=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CC4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C25H22N4O4S/c1-14-10-15(2)23(16(3)11-14)28-24(31)18-6-9-20-21(13-18)34-25(26-20)27-22(30)12-17-4-7-19(8-5-17)29(32)33/h4-11,13H,12H2,1-3H3,(H,28,31)(H,26,27,30)