S-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] heptanethioate

Systemtic Name: S-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] heptanethioate Openeye Name: S-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] heptanethioate CAS Name: heptanethioic acid S-[1-(2,4-dichlorophenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: S-[1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl] heptanethioate Traditional Name: heptanethioic acid S-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] ester Formula: C18H22Cl2N2OS MolecularWeight: 385.35108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)SC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCC(=O)SC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H22Cl2N2OS/c1-2-3-4-5-6-18(23)24-17(12-22-10-9-21-13-22)15-8-7-14(19)11-16(15)20/h7-11,13,17H,2-6,12H2,1H3