methyl 2-[2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C15H15N3O5S MolecularWeight: 349.3617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C15H15N3O5S/c1-9(10-4-3-5-12(6-10)18(21)22)24-15-16-11(7-13(19)17-15)8-14(20)23-2/h3-7,9H,8H2,1-2H3,(H,16,17,19)/t9-/m1/s1