ethyl 2-[4-chloranyl-6-(2,3-dihydro-1H-inden-4-ylamino)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-chloranyl-6-(2,3-dihydro-1H-inden-4-ylamino)pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-chloro-6-(indan-4-ylamino)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-chloro-6-(2,3-dihydro-1H-inden-4-ylamino)-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-chloro-6-(2,3-dihydro-1H-inden-4-ylamino)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-chloro-6-(indan-4-ylamino)pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C17H18ClN3O2S MolecularWeight: 363.86172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=CC(=N1)Cl)NC2=CC=CC3=C2CCC3

Isomeric SMILES

CCOC(=O)CSC1=NC(=CC(=N1)Cl)NC2=CC=CC3=C2CCC3

InChI

InChI=1S/C17H18ClN3O2S/c1-2-23-16(22)10-24-17-20-14(18)9-15(21-17)19-13-8-4-6-11-5-3-7-12(11)13/h4,6,8-9H,2-3,5,7,10H2,1H3,(H,19,20,21)