N-quinazolin-6-yl-2,2-bis(sulfanyl)butanamide

Systemtic Name: N-quinazolin-6-yl-2,2-bis(sulfanyl)butanamide Openeye Name: N-quinazolin-6-yl-2,2-bis(sulfanyl)butanamide CAS Name: 2,2-dimercapto-N-(6-quinazolinyl)butanamide IUPAC Name: N-quinazolin-6-yl-2,2-bis(sulfanyl)butanamide Traditional Name: 2,2-dimercapto-N-quinazolin-6-yl-butyramide Formula: C12H13N3OS2 MolecularWeight: 279.38112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=CN=CN=C2C=C1)(S)S

Isomeric SMILES

CCC(C(=O)NC1=CC2=CN=CN=C2C=C1)(S)S

InChI

InChI=1S/C12H13N3OS2/c1-2-12(17,18)11(16)15-9-3-4-10-8(5-9)6-13-7-14-10/h3-7,17-18H,2H2,1H3,(H,15,16)