2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[(5-methylthiophen-2-yl)methyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[(5-methylthiophen-2-yl)methyl]-N-phenethyl-ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-[(5-methyl-2-thiophenyl)methyl]-N-phenethylacetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(5-methylthiophen-2-yl)methyl]-N-phenethylacetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-acetamide Formula: C20H23N5OS2 MolecularWeight: 413.55952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C20H23N5OS2/c1-14-7-8-16(28-14)12-25(10-9-15-5-3-2-4-6-15)19(26)13-27-20-23-17(21)11-18(22)24-20/h2-8,11H,9-10,12-13H2,1H3,(H4,21,22,23,24)