3-bromanyl-4-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzenecarbonitrile Openeye Name: 3-bromo-4-[[5-(methylsulfanylmethyl)-2-furyl]methylamino]benzonitrile CAS Name: 3-bromo-4-[[5-[(methylthio)methyl]-2-furanyl]methylamino]benzonitrile IUPAC Name: 3-bromo-4-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzonitrile Traditional Name: 3-bromo-4-[[5-[(methylthio)methyl]-2-furyl]methylamino]benzonitrile Formula: C14H13BrN2OS MolecularWeight: 337.23482

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(O1)CNC2=C(C=C(C=C2)C#N)Br

Isomeric SMILES

CSCC1=CC=C(O1)CNC2=C(C=C(C=C2)C#N)Br

InChI

InChI=1S/C14H13BrN2OS/c1-19-9-12-4-3-11(18-12)8-17-14-5-2-10(7-16)6-13(14)15/h2-6,17H,8-9H2,1H3