3-(3-chlorophenyl)-1-[2-methyl-4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one

Systemtic Name: 3-(3-chlorophenyl)-1-[2-methyl-4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one Openeye Name: 3-(3-chlorophenyl)-1-(2-methyl-4-thiazol-2-yl-piperazin-1-yl)prop-2-yn-1-one CAS Name: 3-(3-chlorophenyl)-1-[2-methyl-4-(2-thiazolyl)-1-piperazinyl]-2-propyn-1-one IUPAC Name: 3-(3-chlorophenyl)-1-[2-methyl-4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one Traditional Name: 3-(3-chlorophenyl)-1-(2-methyl-4-thiazol-2-yl-piperazino)prop-2-yn-1-one Formula: C17H16ClN3OS MolecularWeight: 345.84644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C#CC2=CC(=CC=C2)Cl)C3=NC=CS3

Isomeric SMILES

CC1CN(CCN1C(=O)C#CC2=CC(=CC=C2)Cl)C3=NC=CS3

InChI

InChI=1S/C17H16ClN3OS/c1-13-12-20(17-19-7-10-23-17)8-9-21(13)16(22)6-5-14-3-2-4-15(18)11-14/h2-4,7,10-11,13H,8-9,12H2,1H3