2-(6-oxidanylidene-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(6-oxidanylidene-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(6-oxo-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)acetamide CAS Name: 2-[6-oxo-2-(phenethylthio)-4-phenyl-1-pyrimidinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(6-oxo-2-phenethylsulfanyl-4-phenylpyrimidin-1-yl)acetamide Traditional Name: N-benzyl-2-[6-keto-2-(phenethylthio)-4-phenyl-pyrimidin-1-yl]acetamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NC(=CC(=O)N2CC(=O)NCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NC(=CC(=O)N2CC(=O)NCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O2S/c31-25(28-19-22-12-6-2-7-13-22)20-30-26(32)18-24(23-14-8-3-9-15-23)29-27(30)33-17-16-21-10-4-1-5-11-21/h1-15,18H,16-17,19-20H2,(H,28,31)