(E)-4-oxidanylidene-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]but-2-enoic acid Openeye Name: (E)-4-oxo-4-(4-thiazol-2-ylpiperazin-1-yl)but-2-enoic acid CAS Name: (E)-4-oxo-4-[4-(2-thiazolyl)-1-piperazinyl]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]but-2-enoic acid Traditional Name: (E)-4-keto-4-(4-thiazol-2-ylpiperazino)but-2-enoic acid Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CS2)C(=O)C=CC(=O)O

Isomeric SMILES

C1CN(CCN1C2=NC=CS2)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C11H13N3O3S/c15-9(1-2-10(16)17)13-4-6-14(7-5-13)11-12-3-8-18-11/h1-3,8H,4-7H2,(H,16,17)/b2-1+