[3-[(2-chlorophenyl)methyl]-2-(2-sulfanylidenepropyl)imidazol-4-yl] propanoate

Systemtic Name: [3-[(2-chlorophenyl)methyl]-2-(2-sulfanylidenepropyl)imidazol-4-yl] propanoate Openeye Name: [3-[(2-chlorophenyl)methyl]-2-(2-thioxopropyl)imidazol-4-yl] propanoate CAS Name: propanoic acid [3-[(2-chlorophenyl)methyl]-2-(2-sulfanylidenepropyl)-4-imidazolyl] ester IUPAC Name: [3-[(2-chlorophenyl)methyl]-2-(2-sulfanylidenepropyl)imidazol-4-yl] propanoate Traditional Name: propionic acid [3-(2-chlorobenzyl)-2-(2-thioxopropyl)imidazol-4-yl] ester Formula: C16H17ClN2O2S MolecularWeight: 336.83638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CN=C(N1CC2=CC=CC=C2Cl)CC(=S)C

Isomeric SMILES

CCC(=O)OC1=CN=C(N1CC2=CC=CC=C2Cl)CC(=S)C

InChI

InChI=1S/C16H17ClN2O2S/c1-3-16(20)21-15-9-18-14(8-11(2)22)19(15)10-12-6-4-5-7-13(12)17/h4-7,9H,3,8,10H2,1-2H3