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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC2=NC3=CC=CC=C3C(=[N+]2[O-])C

Isomeric SMILES

CC1=CC=CC=C1SCC2=NC3=CC=CC=C3C(=[N+]2[O-])C

InChI

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

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