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

Systemtic Name: 2-(1-phenylethylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(1-phenylethylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[oxo-(1-phenylethylamino)methyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(1-phenylethylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-mesityl-2-(1-phenylethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Formula: C26H26N4O2S MolecularWeight: 458.57524

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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)C4=CC=CC=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C26H26N4O2S/c1-15-12-16(2)23(17(3)13-15)29-24(31)20-10-11-21-22(14-20)33-26(28-21)30-25(32)27-18(4)19-8-6-5-7-9-19/h5-14,18H,1-4H3,(H,29,31)(H2,27,28,30,32)