N-[4-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]-2-methoxy-phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]-2-methoxy-phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[(5-bromo-2-methoxy-3-methyl-benzoyl)carbamothioylamino]-2-methoxy-phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[[[(5-bromo-2-methoxy-3-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-methoxyphenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[(5-bromo-2-methoxy-3-methylbenzoyl)carbamothioylamino]-2-methoxyphenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-[(5-bromo-2-methoxy-3-methyl-benzoyl)thiocarbamoylamino]-2-methoxy-phenyl]coumarilamide Formula: C26H22BrN3O5S MolecularWeight: 568.43898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22BrN3O5S/c1-14-10-16(27)12-18(23(14)34-3)24(31)30-26(36)28-17-8-9-19(21(13-17)33-2)29-25(32)22-11-15-6-4-5-7-20(15)35-22/h4-13H,1-3H3,(H,29,32)(H2,28,30,31,36)