(E)-3-(dimethylamino)-1-[2-(methylamino)-1,3-thiazol-5-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(dimethylamino)-1-[2-(methylamino)-1,3-thiazol-5-yl]prop-2-en-1-one Openeye Name: (E)-3-(dimethylamino)-1-[2-(methylamino)thiazol-5-yl]prop-2-en-1-one CAS Name: (E)-3-(dimethylamino)-1-[2-(methylamino)-5-thiazolyl]-2-propen-1-one IUPAC Name: (E)-3-(dimethylamino)-1-[2-(methylamino)-1,3-thiazol-5-yl]prop-2-en-1-one Traditional Name: (E)-3-(dimethylamino)-1-[2-(methylamino)thiazol-5-yl]prop-2-en-1-one Formula: C9H13N3OS MolecularWeight: 211.28402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C(S1)C(=O)C=CN(C)C

Isomeric SMILES

CNC1=NC=C(S1)C(=O)/C=C/N(C)C

InChI

InChI=1S/C9H13N3OS/c1-10-9-11-6-8(14-9)7(13)4-5-12(2)3/h4-6H,1-3H3,(H,10,11)/b5-4+