N-[3-[(5-bromanylnaphthalen-1-yl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-[(5-bromanylnaphthalen-1-yl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-[(5-bromonaphthalene-1-carbonyl)carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[3-[[[[(5-bromo-1-naphthalenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[3-[(5-bromonaphthalene-1-carbonyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-[(5-bromo-1-naphthoyl)thiocarbamoylamino]phenyl]coumarilamide Formula: C27H18BrN3O3S MolecularWeight: 544.41912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Br

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Br

InChI

InChI=1S/C27H18BrN3O3S/c28-22-12-5-9-19-20(22)10-4-11-21(19)25(32)31-27(35)30-18-8-3-7-17(15-18)29-26(33)24-14-16-6-1-2-13-23(16)34-24/h1-15H,(H,29,33)(H2,30,31,32,35)