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

Systemtic Name: N-[2-methyl-4-[(4-propan-2-ylphenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[(4-isopropylbenzoyl)carbamothioylamino]-2-methyl-phenyl]benzofuran-2-carboxamide CAS Name: N-[2-methyl-4-[[[[oxo-(4-propan-2-ylphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[2-methyl-4-[(4-propan-2-ylbenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-(cumoylthiocarbamoylamino)-2-methyl-phenyl]coumarilamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N3O3S/c1-16(2)18-8-10-19(11-9-18)25(31)30-27(34)28-21-12-13-22(17(3)14-21)29-26(32)24-15-20-6-4-5-7-23(20)33-24/h4-16H,1-3H3,(H,29,32)(H2,28,30,31,34)