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

Systemtic Name: 2-(6-azanyl-4-oxidanylidene-1-phenethyl-pyrimidin-2-yl)sulfanyl-N-naphthalen-2-yl-ethanamide Openeye Name: 2-(6-amino-4-oxo-1-phenethyl-pyrimidin-2-yl)sulfanyl-N-(2-naphthyl)acetamide CAS Name: 2-[(6-amino-4-oxo-1-phenethyl-2-pyrimidinyl)thio]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-(6-amino-4-oxo-1-phenethylpyrimidin-2-yl)sulfanyl-N-naphthalen-2-ylacetamide Traditional Name: 2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]-N-(2-naphthyl)acetamide Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=CC(=O)N=C2SCC(=O)NC3=CC4=CC=CC=C4C=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=CC(=O)N=C2SCC(=O)NC3=CC4=CC=CC=C4C=C3)N

InChI

InChI=1S/C24H22N4O2S/c25-21-15-22(29)27-24(28(21)13-12-17-6-2-1-3-7-17)31-16-23(30)26-20-11-10-18-8-4-5-9-19(18)14-20/h1-11,14-15H,12-13,16,25H2,(H,26,30)