2-[(Z)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl]sulfanylethanoic acid

Systemtic Name: 2-[(Z)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl]sulfanylethanoic acid Openeye Name: 2-[(Z)-4-amino-3-cyano-2-oxo-pent-3-enyl]sulfanylacetic acid CAS Name: 2-[[(Z)-4-amino-3-cyano-2-oxopent-3-enyl]thio]acetic acid IUPAC Name: 2-[(Z)-4-amino-3-cyano-2-oxopent-3-enyl]sulfanylacetic acid Traditional Name: 2-[[(Z)-4-amino-3-cyano-2-keto-pent-3-enyl]thio]acetic acid Formula: C8H10N2O3S MolecularWeight: 214.2416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)CSCC(=O)O)N

Isomeric SMILES

C/C(=C(\C#N)/C(=O)CSCC(=O)O)/N

InChI

InChI=1S/C8H10N2O3S/c1-5(10)6(2-9)7(11)3-14-4-8(12)13/h3-4,10H2,1H3,(H,12,13)/b6-5-