N,N-dimethyl-4-[6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]piperazine-1-sulfonamide

Systemtic Name: N,N-dimethyl-4-[6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]piperazine-1-sulfonamide Openeye Name: N,N-dimethyl-4-[6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanoyl]piperazine-1-sulfonamide CAS Name: N,N-dimethyl-4-[1-oxo-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexyl]-1-piperazinesulfonamide IUPAC Name: N,N-dimethyl-4-[6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]piperazine-1-sulfonamide Traditional Name: 4-[6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanoyl]-N,N-dimethyl-piperazine-1-sulfonamide Formula: C20H29N5O4S2 MolecularWeight: 467.60536

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C20H29N5O4S2/c1-22(2)31(28,29)24-14-12-23(13-15-24)18(26)10-4-3-7-11-25-19(27)16-8-5-6-9-17(16)21-20(25)30/h5-6,8-9H,3-4,7,10-15H2,1-2H3,(H,21,30)