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

Systemtic Name: 2-(6-methylheptan-2-ylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(1,5-dimethylhexylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[(6-methylheptan-2-ylamino)-oxomethyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(6-methylheptan-2-ylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(1,5-dimethylhexylcarbamoylamino)-N-mesityl-1,3-benzothiazole-6-carboxamide Formula: C26H34N4O2S MolecularWeight: 466.63876

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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)NC(C)CCCC(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H34N4O2S/c1-15(2)8-7-9-19(6)27-25(32)30-26-28-21-11-10-20(14-22(21)33-26)24(31)29-23-17(4)12-16(3)13-18(23)5/h10-15,19H,7-9H2,1-6H3,(H,29,31)(H2,27,28,30,32)