1-[4-[(3-oxidanylpyrrolidin-1-yl)methyl]-5-(4-sulfanylphenyl)-1,3-thiazol-2-yl]ethanone

Systemtic Name: 1-[4-[(3-oxidanylpyrrolidin-1-yl)methyl]-5-(4-sulfanylphenyl)-1,3-thiazol-2-yl]ethanone Openeye Name: 1-[4-[(3-hydroxypyrrolidin-1-yl)methyl]-5-(4-sulfanylphenyl)thiazol-2-yl]ethanone CAS Name: 1-[4-[(3-hydroxy-1-pyrrolidinyl)methyl]-5-(4-mercaptophenyl)-2-thiazolyl]ethanone IUPAC Name: 1-[4-[(3-hydroxypyrrolidin-1-yl)methyl]-5-(4-sulfanylphenyl)-1,3-thiazol-2-yl]ethanone Traditional Name: 1-[4-[(3-hydroxypyrrolidino)methyl]-5-(4-mercaptophenyl)thiazol-2-yl]ethanone Formula: C16H18N2O2S2 MolecularWeight: 334.45632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NC(=C(S1)C2=CC=C(C=C2)S)CN3CCC(C3)O

Isomeric SMILES

CC(=O)C1=NC(=C(S1)C2=CC=C(C=C2)S)CN3CCC(C3)O

InChI

InChI=1S/C16H18N2O2S2/c1-10(19)16-17-14(9-18-7-6-12(20)8-18)15(22-16)11-2-4-13(21)5-3-11/h2-5,12,20-21H,6-9H2,1H3