ethyl 4-[2-(2-azanyl-4-methyl-phenyl)sulfanylethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-(2-azanyl-4-methyl-phenyl)sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-(2-amino-4-methyl-phenyl)sulfanylacetyl]amino]butanoate CAS Name: 4-[[2-[(2-amino-4-methylphenyl)thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2-amino-4-methylphenyl)sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(2-amino-4-methyl-phenyl)thio]acetyl]amino]butyric acid ethyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=C(C=C(C=C1)C)N

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=C(C=C(C=C1)C)N

InChI

InChI=1S/C15H22N2O3S/c1-3-20-15(19)5-4-8-17-14(18)10-21-13-7-6-11(2)9-12(13)16/h6-7,9H,3-5,8,10,16H2,1-2H3,(H,17,18)