3-(3-methylbutyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(3-methylbutyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-isopentyl-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(3-methylbutyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(3-methylbutyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-isoamyl-2-thioxo-1H-quinazolin-4-one Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2NC1=S

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2NC1=S

InChI

InChI=1S/C13H16N2OS/c1-9(2)7-8-15-12(16)10-5-3-4-6-11(10)14-13(15)17/h3-6,9H,7-8H2,1-2H3,(H,14,17)