3,5,6-trimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3,5,6-trimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 3,5,6-trimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzofuran-2-carboxamide CAS Name: 3,5,6-trimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-benzofurancarboxamide IUPAC Name: 3,5,6-trimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 3,5,6-trimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]coumarilamide Formula: C26H22N2O2S MolecularWeight: 426.53008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=C(C5=CC(=C(C=C5O4)C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=C(C5=CC(=C(C=C5O4)C)C)C

InChI

InChI=1S/C26H22N2O2S/c1-14-5-10-21-23(11-14)31-26(28-21)18-6-8-19(9-7-18)27-25(29)24-17(4)20-12-15(2)16(3)13-22(20)30-24/h5-13H,1-4H3,(H,27,29)