ethyl 4-azanyl-2-[2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[(4-tert-butylthiazol-2-yl)amino]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[(4-tert-butyl-2-thiazolyl)amino]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[(4-tert-butylthiazol-2-yl)amino]-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C16H21N5O3S2 MolecularWeight: 395.49964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=NC(=CS2)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=NC(=CS2)C(C)(C)C

InChI

InChI=1S/C16H21N5O3S2/c1-5-24-13(23)9-6-18-14(21-12(9)17)26-8-11(22)20-15-19-10(7-25-15)16(2,3)4/h6-7H,5,8H2,1-4H3,(H2,17,18,21)(H,19,20,22)