ethyl 2-[2-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoyl]amino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoyl]amino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-1-oxobutyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-butanoyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C20H25N3O7S2 MolecularWeight: 483.5584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H25N3O7S2/c1-4-28-17(24)9-13-11-31-20(21-13)22-19(25)18(12(2)3)23-32(26,27)14-5-6-15-16(10-14)30-8-7-29-15/h5-6,10-12,18,23H,4,7-9H2,1-3H3,(H,21,22,25)/t18-/m0/s1