N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-3-(methylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-[4-[4-(acetamidomethyl)phenyl]-2-thiazolyl]-3-[(methylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-3-[(methylthio)methyl]coumarilamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC

InChI

InChI=1S/C23H21N3O3S2/c1-14(27)24-11-15-7-9-16(10-8-15)19-13-31-23(25-19)26-22(28)21-18(12-30-2)17-5-3-4-6-20(17)29-21/h3-10,13H,11-12H2,1-2H3,(H,24,27)(H,25,26,28)