ethyl 2-[1-[3-(1H-imidazol-5-yl)prop-2-enoyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[1-[3-(1H-imidazol-5-yl)prop-2-enoyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[1-[3-(1H-imidazol-5-yl)prop-2-enoyl]-4-piperidyl]thiazole-4-carboxylate CAS Name: 2-[1-[3-(1H-imidazol-5-yl)-1-oxoprop-2-enyl]-4-piperidinyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-[3-(1H-imidazol-5-yl)prop-2-enoyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[1-[3-(1H-imidazol-5-yl)acryloyl]-4-piperidyl]thiazole-4-carboxylic acid ethyl ester Formula: C17H20N4O3S MolecularWeight: 360.4307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C=CC3=CN=CN3

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C=CC3=CN=CN3

InChI

InChI=1S/C17H20N4O3S/c1-2-24-17(23)14-10-25-16(20-14)12-5-7-21(8-6-12)15(22)4-3-13-9-18-11-19-13/h3-4,9-12H,2,5-8H2,1H3,(H,18,19)