4,7-dimethyl-2-(phenylmethylsulfanyl)quinazoline

Systemtic Name: 4,7-dimethyl-2-(phenylmethylsulfanyl)quinazoline Openeye Name: 2-benzylsulfanyl-4,7-dimethyl-quinazoline CAS Name: 4,7-dimethyl-2-(phenylmethylthio)quinazoline IUPAC Name: 2-benzylsulfanyl-4,7-dimethylquinazoline Traditional Name: 2-(benzylthio)-4,7-dimethyl-quinazoline Formula: C17H16N2S MolecularWeight: 280.38734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)SCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)SCC3=CC=CC=C3)C

InChI

InChI=1S/C17H16N2S/c1-12-8-9-15-13(2)18-17(19-16(15)10-12)20-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3