(E)-5-[3,4-bis(azanyl)thiophen-2-yl]pent-2-enoic acid

Systemtic Name: (E)-5-[3,4-bis(azanyl)thiophen-2-yl]pent-2-enoic acid Openeye Name: (E)-5-(3,4-diamino-2-thienyl)pent-2-enoic acid CAS Name: (E)-5-(3,4-diamino-2-thiophenyl)-2-pentenoic acid IUPAC Name: (E)-5-(3,4-diaminothiophen-2-yl)pent-2-enoic acid Traditional Name: (E)-5-(3,4-diamino-2-thienyl)pent-2-enoic acid Formula: C9H12N2O2S MolecularWeight: 212.26878

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(S1)CCC=CC(=O)O)N)N

Isomeric SMILES

C1=C(C(=C(S1)CC/C=C/C(=O)O)N)N

InChI

InChI=1S/C9H12N2O2S/c10-6-5-14-7(9(6)11)3-1-2-4-8(12)13/h2,4-5H,1,3,10-11H2,(H,12,13)/b4-2+