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2-[6-oxidanylidene-5-(phenylmethoxycarbonylamino)-2-thiophen-2-yl-pyrimidin-1-yl]ethanoic acid

2-[6-oxidanylidene-5-(phenylmethoxycarbonylamino)-2-thiophen-2-yl-pyrimidin-1-yl]ethanoic acid

Systemtic Name:2-[6-oxidanylidene-5-(phenylmethoxycarbonylamino)-2-thiophen-2-yl-pyrimidin-1-yl]ethanoic acid
Openeye Name:2-[5-(benzyloxycarbonylamino)-6-oxo-2-(2-thienyl)pyrimidin-1-yl]acetic acid
CAS Name:2-[6-oxo-5-(phenylmethoxycarbonylamino)-2-thiophen-2-yl-1-pyrimidinyl]acetic acid
IUPAC Name:2-[6-oxo-5-(phenylmethoxycarbonylamino)-2-thiophen-2-ylpyrimidin-1-yl]acetic acid
Traditional Name:2-[5-(benzyloxycarbonylamino)-6-keto-2-(2-thienyl)pyrimidin-1-yl]acetic acid
Formula: C18H15N3O5S
MolecularWeight: 385.3938
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=CN=C(N(C2=O)CC(=O)O)C3=CC=CS3


Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=CN=C(N(C2=O)CC(=O)O)C3=CC=CS3


InChI

InChI=1S/C18H15N3O5S/c22-15(23)10-21-16(14-7-4-8-27-14)19-9-13(17(21)24)20-18(25)26-11-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,20,25)(H,22,23)


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