2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(diethylamino)phenyl]ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(diethylamino)phenyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(diethylamino)phenyl]acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[4-(diethylamino)phenyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(diethylamino)phenyl]acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-[4-(diethylamino)phenyl]acetamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O2S/c1-3-21(4-2)12-7-5-11(6-8-12)18-15(23)10-24-16-19-13(17)9-14(22)20-16/h5-9H,3-4,10H2,1-2H3,(H,18,23)(H3,17,19,20,22)