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4-methyl-2-[(4-methylphenyl)sulfanylmethyl]-3-oxidanidyl-quinazolin-3-ium

4-methyl-2-[(4-methylphenyl)sulfanylmethyl]-3-oxidanidyl-quinazolin-3-ium

Systemtic Name:4-methyl-2-[(4-methylphenyl)sulfanylmethyl]-3-oxidanidyl-quinazolin-3-ium
Openeye Name:4-methyl-3-oxido-2-(p-tolylsulfanylmethyl)quinazolin-3-ium
CAS Name:4-methyl-2-[[(4-methylphenyl)thio]methyl]-3-oxidoquinazolin-3-ium
IUPAC Name:4-methyl-2-[(4-methylphenyl)sulfanylmethyl]-3-oxidoquinazolin-3-ium
Traditional Name:4-methyl-3-oxido-2-[(p-tolylthio)methyl]quinazolin-3-ium
Formula: C17H16N2OS
MolecularWeight: 296.38674
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NC3=CC=CC=C3C(=[N+]2[O-])C


Isomeric SMILES

CC1=CC=C(C=C1)SCC2=NC3=CC=CC=C3C(=[N+]2[O-])C


InChI

InChI=1S/C17H16N2OS/c1-12-7-9-14(10-8-12)21-11-17-18-16-6-4-3-5-15(16)13(2)19(17)20/h3-10H,11H2,1-2H3


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