3-(2-azanyl-1,3-thiazol-4-yl)but-3-enoic acid

Systemtic Name: 3-(2-azanyl-1,3-thiazol-4-yl)but-3-enoic acid Openeye Name: 3-(2-aminothiazol-4-yl)but-3-enoic acid CAS Name: 3-(2-amino-4-thiazolyl)-3-butenoic acid IUPAC Name: 3-(2-amino-1,3-thiazol-4-yl)but-3-enoic acid Traditional Name: 3-(2-aminothiazol-4-yl)but-3-enoic acid Formula: C7H8N2O2S MolecularWeight: 184.21562

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CC(=O)O)C1=CSC(=N1)N

Isomeric SMILES

C=C(CC(=O)O)C1=CSC(=N1)N

InChI

InChI=1S/C7H8N2O2S/c1-4(2-6(10)11)5-3-12-7(8)9-5/h3H,1-2H2,(H2,8,9)(H,10,11)