N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-[4-(2,5-dimethylphenyl)thiazol-2-yl]benzofuran-2-carboxamide CAS Name: N-[4-(2,5-dimethylphenyl)-2-thiazolyl]-3-[(phenylmethylthio)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-[4-(2,5-dimethylphenyl)thiazol-2-yl]coumarilamide Formula: C28H24N2O2S2 MolecularWeight: 484.63236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NC(=O)C3=C(C4=CC=CC=C4O3)CSCC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NC(=O)C3=C(C4=CC=CC=C4O3)CSCC5=CC=CC=C5

InChI

InChI=1S/C28H24N2O2S2/c1-18-12-13-19(2)22(14-18)24-17-34-28(29-24)30-27(31)26-23(21-10-6-7-11-25(21)32-26)16-33-15-20-8-4-3-5-9-20/h3-14,17H,15-16H2,1-2H3,(H,29,30,31)