2-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-1-yl]-N-(2-phenylsulfanylethyl)ethanamide

Systemtic Name: 2-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-1-yl]-N-(2-phenylsulfanylethyl)ethanamide Openeye Name: 2-(3-benzyl-2,6-dioxo-pyrimidin-1-yl)-N-(2-phenylsulfanylethyl)acetamide CAS Name: 2-[2,6-dioxo-3-(phenylmethyl)-1-pyrimidinyl]-N-[2-(phenylthio)ethyl]acetamide IUPAC Name: 2-(3-benzyl-2,6-dioxopyrimidin-1-yl)-N-(2-phenylsulfanylethyl)acetamide Traditional Name: 2-(3-benzyl-2,6-diketo-pyrimidin-1-yl)-N-[2-(phenylthio)ethyl]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC(=O)N(C2=O)CC(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC(=O)N(C2=O)CC(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c25-19(22-12-14-28-18-9-5-2-6-10-18)16-24-20(26)11-13-23(21(24)27)15-17-7-3-1-4-8-17/h1-11,13H,12,14-16H2,(H,22,25)