2-[(4-chlorophenyl)methylsulfanyl]-4,7-dimethyl-quinazoline

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-4,7-dimethyl-quinazoline Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-4,7-dimethyl-quinazoline CAS Name: 2-[(4-chlorophenyl)methylthio]-4,7-dimethylquinazoline IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-4,7-dimethylquinazoline Traditional Name: 2-[(4-chlorobenzyl)thio]-4,7-dimethyl-quinazoline Formula: C17H15ClN2S MolecularWeight: 314.8324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClN2S/c1-11-3-8-15-12(2)19-17(20-16(15)9-11)21-10-13-4-6-14(18)7-5-13/h3-9H,10H2,1-2H3