S-(3-butyl-4-oxidanylidene-quinazolin-2-yl) methanethioate

Systemtic Name: S-(3-butyl-4-oxidanylidene-quinazolin-2-yl) methanethioate Openeye Name: S-(3-butyl-4-oxo-quinazolin-2-yl) methanethioate CAS Name: methanethioic acid S-(3-butyl-4-oxo-2-quinazolinyl) ester IUPAC Name: S-(3-butyl-4-oxoquinazolin-2-yl) methanethioate Traditional Name: methanethioic acid S-(3-butyl-4-keto-quinazolin-2-yl) ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SC=O

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SC=O

InChI

InChI=1S/C13H14N2O2S/c1-2-3-8-15-12(17)10-6-4-5-7-11(10)14-13(15)18-9-16/h4-7,9H,2-3,8H2,1H3