N-[[4-(1,3-benzoxazol-2-yl)phenyl]methylcarbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[4-(1,3-benzoxazol-2-yl)phenyl]methylcarbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[4-(1,3-benzoxazol-2-yl)phenyl]methylcarbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[[4-(1,3-benzoxazol-2-yl)phenyl]methylamino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[[4-(1,3-benzoxazol-2-yl)phenyl]methylcarbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[4-(1,3-benzoxazol-2-yl)benzyl]thiocarbamoyl]coumarilamide Formula: C24H17N3O3S MolecularWeight: 427.47508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C24H17N3O3S/c28-22(21-13-17-5-1-3-7-19(17)29-21)27-24(31)25-14-15-9-11-16(12-10-15)23-26-18-6-2-4-8-20(18)30-23/h1-13H,14H2,(H2,25,27,28,31)