3-[2-(4-chlorophenyl)sulfanylethyl]quinazolin-4-one

Systemtic Name: 3-[2-(4-chlorophenyl)sulfanylethyl]quinazolin-4-one Openeye Name: 3-[2-(4-chlorophenyl)sulfanylethyl]quinazolin-4-one CAS Name: 3-[2-[(4-chlorophenyl)thio]ethyl]-4-quinazolinone IUPAC Name: 3-[2-(4-chlorophenyl)sulfanylethyl]quinazolin-4-one Traditional Name: 3-[2-[(4-chlorophenyl)thio]ethyl]quinazolin-4-one Formula: C16H13ClN2OS MolecularWeight: 316.80522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2OS/c17-12-5-7-13(8-6-12)21-10-9-19-11-18-15-4-2-1-3-14(15)16(19)20/h1-8,11H,9-10H2