N-[(E)-(4-bromanyl-5-methyl-furan-2-yl)methylideneamino]-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[(E)-(4-bromanyl-5-methyl-furan-2-yl)methylideneamino]-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-[(E)-(4-bromo-5-methyl-2-furyl)methyleneamino]propanamide CAS Name: N-[(E)-(4-bromo-5-methyl-2-furanyl)methylideneamino]-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-[(E)-(4-bromo-5-methylfuran-2-yl)methylideneamino]propanamide Traditional Name: 2-(benzylthio)-N-[(E)-(4-bromo-5-methyl-2-furyl)methyleneamino]propionamide Formula: C16H17BrN2O2S MolecularWeight: 381.28738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C=NNC(=O)C(C)SCC2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(O1)/C=N/NC(=O)C(C)SCC2=CC=CC=C2)Br

InChI

InChI=1S/C16H17BrN2O2S/c1-11-15(17)8-14(21-11)9-18-19-16(20)12(2)22-10-13-6-4-3-5-7-13/h3-9,12H,10H2,1-2H3,(H,19,20)/b18-9+