2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-methyl-N-(thiophen-3-ylmethyl)ethanamide

Systemtic Name: 2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-methyl-N-(thiophen-3-ylmethyl)ethanamide Openeye Name: 2-[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-methyl-N-(3-thienylmethyl)acetamide CAS Name: 2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-2-pyrimidinyl]thio]-N-methyl-N-(3-thiophenylmethyl)acetamide IUPAC Name: 2-[4-amino-5-(4-chlorophenyl)-6-ethylpyrimidin-2-yl]sulfanyl-N-methyl-N-(thiophen-3-ylmethyl)acetamide Traditional Name: 2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]thio]-N-methyl-N-(3-thenyl)acetamide Formula: C20H21ClN4OS2 MolecularWeight: 432.98994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)SCC(=O)N(C)CC2=CSC=C2)N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)SCC(=O)N(C)CC2=CSC=C2)N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN4OS2/c1-3-16-18(14-4-6-15(21)7-5-14)19(22)24-20(23-16)28-12-17(26)25(2)10-13-8-9-27-11-13/h4-9,11H,3,10,12H2,1-2H3,(H2,22,23,24)