ethyl 4-[2-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanyl]ethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanyl]ethanoylamino]butanoate Openeye Name: ethyl 4-[[2-(2-amino-4-methyl-thiazol-5-yl)sulfanylacetyl]amino]butanoate CAS Name: 4-[[2-[(2-amino-4-methyl-5-thiazolyl)thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfanyl]acetyl]amino]butanoate Traditional Name: 4-[[2-[(2-amino-4-methyl-thiazol-5-yl)thio]acetyl]amino]butyric acid ethyl ester Formula: C12H19N3O3S2 MolecularWeight: 317.42756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=C(N=C(S1)N)C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=C(N=C(S1)N)C

InChI

InChI=1S/C12H19N3O3S2/c1-3-18-10(17)5-4-6-14-9(16)7-19-11-8(2)15-12(13)20-11/h3-7H2,1-2H3,(H2,13,15)(H,14,16)