2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-(2-methoxyethylcarbamoyl)ethanamide

Systemtic Name: 2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-(2-methoxyethylcarbamoyl)ethanamide Openeye Name: 2-[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-(2-methoxyethylcarbamoyl)acetamide CAS Name: 2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-2-pyrimidinyl]thio]-N-[(2-methoxyethylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-amino-5-(4-chlorophenyl)-6-ethylpyrimidin-2-yl]sulfanyl-N-(2-methoxyethylcarbamoyl)acetamide Traditional Name: 2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]thio]-N-(2-methoxyethylcarbamoyl)acetamide Formula: C18H22ClN5O3S MolecularWeight: 423.91698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)SCC(=O)NC(=O)NCCOC)N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)SCC(=O)NC(=O)NCCOC)N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H22ClN5O3S/c1-3-13-15(11-4-6-12(19)7-5-11)16(20)24-18(22-13)28-10-14(25)23-17(26)21-8-9-27-2/h4-7H,3,8-10H2,1-2H3,(H2,20,22,24)(H2,21,23,25,26)