3-methylidene-2-[2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]isoindol-1-one

Systemtic Name: 3-methylidene-2-[2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]isoindol-1-one Openeye Name: 3-methylene-2-[2-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-yl]-2-oxo-ethyl]isoindolin-1-one CAS Name: 3-methylene-2-[2-[4-[(2-methyl-4-thiazolyl)methyl]-1-piperazinyl]-2-oxoethyl]-1-isoindolone IUPAC Name: 3-methylidene-2-[2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-2-oxoethyl]isoindol-1-one Traditional Name: 2-[2-keto-2-[4-[(2-methylthiazol-4-yl)methyl]piperazino]ethyl]-3-methylene-isoindolin-1-one Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCN(CC2)C(=O)CN3C(=C)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=NC(=CS1)CN2CCN(CC2)C(=O)CN3C(=C)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H22N4O2S/c1-14-17-5-3-4-6-18(17)20(26)24(14)12-19(25)23-9-7-22(8-10-23)11-16-13-27-15(2)21-16/h3-6,13H,1,7-12H2,2H3