tert-butyl 3-[[5-(2-cyclopropylpyrimidin-4-yl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]propanoate

Systemtic Name: tert-butyl 3-[[5-(2-cyclopropylpyrimidin-4-yl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]propanoate Openeye Name: tert-butyl 3-[[5-(2-cyclopropylpyrimidin-4-yl)-4-methyl-thiazol-2-yl]carbamoylamino]propanoate CAS Name: 3-[[[[5-(2-cyclopropyl-4-pyrimidinyl)-4-methyl-2-thiazolyl]amino]-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[5-(2-cyclopropylpyrimidin-4-yl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]propanoate Traditional Name: 3-[[5-(2-cyclopropylpyrimidin-4-yl)-4-methyl-thiazol-2-yl]carbamoylamino]propionic acid tert-butyl ester Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)NCCC(=O)OC(C)(C)C)C2=NC(=NC=C2)C3CC3

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)NCCC(=O)OC(C)(C)C)C2=NC(=NC=C2)C3CC3

InChI

InChI=1S/C19H25N5O3S/c1-11-15(13-7-9-20-16(23-13)12-5-6-12)28-18(22-11)24-17(26)21-10-8-14(25)27-19(2,3)4/h7,9,12H,5-6,8,10H2,1-4H3,(H2,21,22,24,26)