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

Systemtic Name: tert-butyl 3-[[5-[2-(dimethylamino)pyrimidin-4-yl]-4-methyl-1,3-thiazol-2-yl]carbamoylamino]propanoate Openeye Name: tert-butyl 3-[[5-[2-(dimethylamino)pyrimidin-4-yl]-4-methyl-thiazol-2-yl]carbamoylamino]propanoate CAS Name: 3-[[[[5-[2-(dimethylamino)-4-pyrimidinyl]-4-methyl-2-thiazolyl]amino]-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[5-[2-(dimethylamino)pyrimidin-4-yl]-4-methyl-1,3-thiazol-2-yl]carbamoylamino]propanoate Traditional Name: 3-[[5-[2-(dimethylamino)pyrimidin-4-yl]-4-methyl-thiazol-2-yl]carbamoylamino]propionic acid tert-butyl ester Formula: C18H26N6O3S MolecularWeight: 406.50244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N6O3S/c1-11-14(12-7-9-19-15(22-12)24(5)6)28-17(21-11)23-16(26)20-10-8-13(25)27-18(2,3)4/h7,9H,8,10H2,1-6H3,(H2,20,21,23,26)