N-[4-[(2-chloranyl-4-methyl-phenyl)carbonylcarbamothioylamino]-2-methyl-phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-[(2-chloranyl-4-methyl-phenyl)carbonylcarbamothioylamino]-2-methyl-phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[(2-chloro-4-methyl-benzoyl)carbamothioylamino]-2-methyl-phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[[[(2-chloro-4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-methylphenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[(2-chloro-4-methylbenzoyl)carbamothioylamino]-2-methylphenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-[(2-chloro-4-methyl-benzoyl)thiocarbamoylamino]-2-methyl-phenyl]coumarilamide Formula: C25H20ClN3O3S MolecularWeight: 477.9626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)C)Cl

InChI

InChI=1S/C25H20ClN3O3S/c1-14-7-9-18(19(26)11-14)23(30)29-25(33)27-17-8-10-20(15(2)12-17)28-24(31)22-13-16-5-3-4-6-21(16)32-22/h3-13H,1-2H3,(H,28,31)(H2,27,29,30,33)