methyl 4-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-[[2-(4-methoxyphenyl)-4-thiazolyl]methyl]-1-piperazinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazino]butyric acid methyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C(=O)CCC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C(=O)CCC(=O)OC

InChI

InChI=1S/C20H25N3O4S/c1-26-17-5-3-15(4-6-17)20-21-16(14-28-20)13-22-9-11-23(12-10-22)18(24)7-8-19(25)27-2/h3-6,14H,7-13H2,1-2H3