ethyl 4-[2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[1-(m-tolyl)imidazol-2-yl]sulfanylacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[1-(3-methylphenyl)-2-imidazolyl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[1-(m-tolyl)imidazol-2-yl]thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H24N4O3S MolecularWeight: 388.48386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC=CN2C3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC=CN2C3=CC=CC(=C3)C

InChI

InChI=1S/C19H24N4O3S/c1-3-26-19(25)22-11-9-21(10-12-22)17(24)14-27-18-20-7-8-23(18)16-6-4-5-15(2)13-16/h4-8,13H,3,9-12,14H2,1-2H3