N-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propyl]methanesulfonamide

Systemtic Name: N-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propyl]methanesulfonamide Openeye Name: N-[3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propyl]methanesulfonamide CAS Name: N-[3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]methanesulfonamide IUPAC Name: N-[3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]methanesulfonamide Traditional Name: N-[3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propyl]methanesulfonamide Formula: C12H15N3O3S2 MolecularWeight: 313.3958

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCCN1C(=O)C2=CC=CC=C2NC1=S

Isomeric SMILES

CS(=O)(=O)NCCCN1C(=O)C2=CC=CC=C2NC1=S

InChI

InChI=1S/C12H15N3O3S2/c1-20(17,18)13-7-4-8-15-11(16)9-5-2-3-6-10(9)14-12(15)19/h2-3,5-6,13H,4,7-8H2,1H3,(H,14,19)