2-(furan-2-ylmethylsulfanylmethyl)-4-methyl-3-oxidanidyl-quinazolin-3-ium

Systemtic Name: 2-(furan-2-ylmethylsulfanylmethyl)-4-methyl-3-oxidanidyl-quinazolin-3-ium Openeye Name: 2-(2-furylmethylsulfanylmethyl)-4-methyl-3-oxido-quinazolin-3-ium CAS Name: 2-[(2-furanylmethylthio)methyl]-4-methyl-3-oxidoquinazolin-3-ium IUPAC Name: 2-(furan-2-ylmethylsulfanylmethyl)-4-methyl-3-oxidoquinazolin-3-ium Traditional Name: 2-[(2-furfurylthio)methyl]-4-methyl-3-oxido-quinazolin-3-ium Formula: C15H14N2O2S MolecularWeight: 286.34886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=NC2=CC=CC=C12)CSCC3=CC=CO3)[O-]

Isomeric SMILES

CC1=[N+](C(=NC2=CC=CC=C12)CSCC3=CC=CO3)[O-]

InChI

InChI=1S/C15H14N2O2S/c1-11-13-6-2-3-7-14(13)16-15(17(11)18)10-20-9-12-5-4-8-19-12/h2-8H,9-10H2,1H3