2-(6-azanyl-4-oxidanylidene-1-phenethyl-pyrimidin-2-yl)sulfanyl-N-naphthalen-1-yl-propanamide

Systemtic Name: 2-(6-azanyl-4-oxidanylidene-1-phenethyl-pyrimidin-2-yl)sulfanyl-N-naphthalen-1-yl-propanamide Openeye Name: 2-(6-amino-4-oxo-1-phenethyl-pyrimidin-2-yl)sulfanyl-N-(1-naphthyl)propanamide CAS Name: 2-[(6-amino-4-oxo-1-phenethyl-2-pyrimidinyl)thio]-N-(1-naphthalenyl)propanamide IUPAC Name: 2-(6-amino-4-oxo-1-phenethylpyrimidin-2-yl)sulfanyl-N-naphthalen-1-ylpropanamide Traditional Name: 2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]-N-(1-naphthyl)propionamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC(=O)C=C(N3CCC4=CC=CC=C4)N

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC(=O)C=C(N3CCC4=CC=CC=C4)N

InChI

InChI=1S/C25H24N4O2S/c1-17(24(31)27-21-13-7-11-19-10-5-6-12-20(19)21)32-25-28-23(30)16-22(26)29(25)15-14-18-8-3-2-4-9-18/h2-13,16-17H,14-15,26H2,1H3,(H,27,31)