2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[4-(diethylamino)phenyl]ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[4-(diethylamino)phenyl]ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[4-(diethylamino)phenyl]acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-[4-(diethylamino)phenyl]acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[4-(diethylamino)phenyl]acetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-[4-(diethylamino)phenyl]acetamide Formula: C16H22N6OS MolecularWeight: 346.45048

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C16H22N6OS/c1-3-22(4-2)12-7-5-11(6-8-12)19-15(23)10-24-16-20-13(17)9-14(18)21-16/h5-9H,3-4,10H2,1-2H3,(H,19,23)(H4,17,18,20,21)