5-bromanyl-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]furan-2-carboxamide Openeye Name: N-[(1-benzyl-4-piperidyl)carbamothioyl]-5-bromo-furan-2-carboxamide CAS Name: 5-bromo-N-[[[1-(phenylmethyl)-4-piperidinyl]amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[(1-benzylpiperidin-4-yl)carbamothioyl]-5-bromofuran-2-carboxamide Traditional Name: N-[(1-benzyl-4-piperidyl)thiocarbamoyl]-5-bromo-2-furamide Formula: C18H20BrN3O2S MolecularWeight: 422.3393

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=S)NC(=O)C2=CC=C(O2)Br)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=S)NC(=O)C2=CC=C(O2)Br)CC3=CC=CC=C3

InChI

InChI=1S/C18H20BrN3O2S/c19-16-7-6-15(24-16)17(23)21-18(25)20-14-8-10-22(11-9-14)12-13-4-2-1-3-5-13/h1-7,14H,8-12H2,(H2,20,21,23,25)