2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-phenethyl-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-phenethyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-phenethyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-phenethyl-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-phenethyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-phenethyl-N-(2-thenyl)acetamide Formula: C19H21N5OS2 MolecularWeight: 399.53294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CS2)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CS2)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C19H21N5OS2/c20-16-11-17(21)23-19(22-16)27-13-18(25)24(12-15-7-4-10-26-15)9-8-14-5-2-1-3-6-14/h1-7,10-11H,8-9,12-13H2,(H4,20,21,22,23)