cyclopropylmethyl 2-[4-azanyl-5-(phenylmethyl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: cyclopropylmethyl 2-[4-azanyl-5-(phenylmethyl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: cyclopropylmethyl 2-(4-amino-5-benzyl-pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[[4-amino-5-(phenylmethyl)-2-pyrimidinyl]thio]acetic acid cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl 2-(4-amino-5-benzylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4-amino-5-benzyl-pyrimidin-2-yl)thio]acetic acid cyclopropylmethyl ester Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC(=O)CSC2=NC=C(C(=N2)N)CC3=CC=CC=C3

Isomeric SMILES

C1CC1COC(=O)CSC2=NC=C(C(=N2)N)CC3=CC=CC=C3

InChI

InChI=1S/C17H19N3O2S/c18-16-14(8-12-4-2-1-3-5-12)9-19-17(20-16)23-11-15(21)22-10-13-6-7-13/h1-5,9,13H,6-8,10-11H2,(H2,18,19,20)