methyl 2-[2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: methyl 2-[2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: methyl 2-[2-[3-(1,3-benzodioxol-5-yl)propanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[3-(1,3-benzodioxol-5-yl)-1-oxopropyl]amino]-4-thiazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-(1,3-benzodioxol-5-yl)propanoylamino]thiazol-4-yl]acetic acid methyl ester Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CSC(=N1)NC(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)CC1=CSC(=N1)NC(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H16N2O5S/c1-21-15(20)7-11-8-24-16(17-11)18-14(19)5-3-10-2-4-12-13(6-10)23-9-22-12/h2,4,6,8H,3,5,7,9H2,1H3,(H,17,18,19)