ethyl 2-[2-[(6-azanyl-5-nitro-pyrimidin-4-yl)amino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(6-azanyl-5-nitro-pyrimidin-4-yl)amino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(6-amino-5-nitro-pyrimidin-4-yl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[(6-amino-5-nitro-4-pyrimidinyl)amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(6-amino-5-nitropyrimidin-4-yl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(6-amino-5-nitro-pyrimidin-4-yl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C11H12N6O4S MolecularWeight: 324.31578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC2=NC=NC(=C2[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC2=NC=NC(=C2[N+](=O)[O-])N

InChI

InChI=1S/C11H12N6O4S/c1-2-21-7(18)3-6-4-22-11(15-6)16-10-8(17(19)20)9(12)13-5-14-10/h4-5H,2-3H2,1H3,(H3,12,13,14,15,16)