5-(thian-4-ylamino)benzene-1,3-dicarboxamide

Systemtic Name: 5-(thian-4-ylamino)benzene-1,3-dicarboxamide Openeye Name: 5-(tetrahydrothiopyran-4-ylamino)benzene-1,3-dicarboxamide CAS Name: 5-(4-thianylamino)benzene-1,3-dicarboxamide IUPAC Name: 5-(thian-4-ylamino)benzene-1,3-dicarboxamide Traditional Name: 5-(tetrahydrothiopyran-4-ylamino)isophthalamide Formula: C13H17N3O2S MolecularWeight: 279.35798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=CC(=CC(=C2)C(=O)N)C(=O)N

Isomeric SMILES

C1CSCCC1NC2=CC(=CC(=C2)C(=O)N)C(=O)N

InChI

InChI=1S/C13H17N3O2S/c14-12(17)8-5-9(13(15)18)7-11(6-8)16-10-1-3-19-4-2-10/h5-7,10,16H,1-4H2,(H2,14,17)(H2,15,18)