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

Systemtic Name: ethyl 4-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H21ClN4O3S MolecularWeight: 408.90234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN4O3S/c1-2-26-18(25)22-10-8-21(9-11-22)16(24)13-27-17-20-6-7-23(17)15-5-3-4-14(19)12-15/h3-7,12H,2,8-11,13H2,1H3