(E)-4-oxidanylidene-4-[2-(propan-2-ylamino)ethylcarbamoyloxy]but-2-enoate; 1,3-thiazole

Systemtic Name: (E)-4-oxidanylidene-4-[2-(propan-2-ylamino)ethylcarbamoyloxy]but-2-enoate; 1,3-thiazole Openeye Name: (E)-4-[2-(isopropylamino)ethylcarbamoyloxy]-4-oxo-but-2-enoate; thiazole CAS Name: (E)-4-oxo-4-[oxo-[2-(propan-2-ylamino)ethylamino]methoxy]-2-butenoate; thiazole IUPAC Name: (E)-4-oxo-4-[2-(propan-2-ylamino)ethylcarbamoyloxy]but-2-enoate; 1,3-thiazole Traditional Name: (E)-4-[2-(isopropylamino)ethylcarbamoyloxy]-4-keto-but-2-enoate; thiazole Formula: C13H18N3O5S- MolecularWeight: 328.36412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCNC(=O)OC(=O)C=CC(=O)[O-].C1=CSC=N1

Isomeric SMILES

CC(C)NCCNC(=O)OC(=O)/C=C/C(=O)[O-].C1=CSC=N1

InChI

InChI=1S/C10H16N2O5.C3H3NS/c1-7(2)11-5-6-12-10(16)17-9(15)4-3-8(13)14;1-2-5-3-4-1/h3-4,7,11H,5-6H2,1-2H3,(H,12,16)(H,13,14);1-3H/p-1/b4-3+;