ethyl 2-[2-[[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[3-tert-butyl-1-(phenylmethyl)-4-pyrazolyl]sulfonylamino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(1-benzyl-3-tert-butylpyrazol-4-yl)sulfonylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NS(=O)(=O)C2=CN(N=C2C(C)(C)C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NS(=O)(=O)C2=CN(N=C2C(C)(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4S2/c1-5-29-18(26)11-16-14-30-20(22-16)24-31(27,28)17-13-25(23-19(17)21(2,3)4)12-15-9-7-6-8-10-15/h6-10,13-14H,5,11-12H2,1-4H3,(H,22,24)