methyl 3-[2-[3-methyl-1-(phenylmethoxycarbonylamino)butyl]-1,3-thiazol-5-yl]propanoate

Systemtic Name: methyl 3-[2-[3-methyl-1-(phenylmethoxycarbonylamino)butyl]-1,3-thiazol-5-yl]propanoate Openeye Name: methyl 3-[2-[1-(benzyloxycarbonylamino)-3-methyl-butyl]thiazol-5-yl]propanoate CAS Name: 3-[2-[3-methyl-1-(phenylmethoxycarbonylamino)butyl]-5-thiazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[3-methyl-1-(phenylmethoxycarbonylamino)butyl]-1,3-thiazol-5-yl]propanoate Traditional Name: 3-[2-[1-(benzyloxycarbonylamino)-3-methyl-butyl]thiazol-5-yl]propionic acid methyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC=C(S1)CCC(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C1=NC=C(S1)CCC(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O4S/c1-14(2)11-17(19-21-12-16(27-19)9-10-18(23)25-3)22-20(24)26-13-15-7-5-4-6-8-15/h4-8,12,14,17H,9-11,13H2,1-3H3,(H,22,24)