4-[2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanylacetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-2-pyrimidinyl]thio]-1-oxoethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[4-amino-5-(4-chlorophenyl)-6-ethylpyrimidin-2-yl]sulfanylacetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C22H20ClN5O2S MolecularWeight: 453.9445

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)SCC(=O)N2CC(=O)NC3=CC=CC=C32)N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)SCC(=O)N2CC(=O)NC3=CC=CC=C32)N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5O2S/c1-2-15-20(13-7-9-14(23)10-8-13)21(24)27-22(26-15)31-12-19(30)28-11-18(29)25-16-5-3-4-6-17(16)28/h3-10H,2,11-12H2,1H3,(H,25,29)(H2,24,26,27)