N-[6-azanyl-2-(2-ethoxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[6-azanyl-2-(2-ethoxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[6-amino-2-(2-ethoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-3,4-dimethoxy-benzamide CAS Name: N-[6-amino-2-(2-ethoxyethylthio)-4-oxo-1H-pyrimidin-5-yl]-3,4-dimethoxybenzamide IUPAC Name: N-[6-amino-2-(2-ethoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-3,4-dimethoxybenzamide Traditional Name: N-[6-amino-2-(2-ethoxyethylthio)-4-keto-1H-pyrimidin-5-yl]-3,4-dimethoxy-benzamide Formula: C17H22N4O5S MolecularWeight: 394.44538

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H22N4O5S/c1-4-26-7-8-27-17-20-14(18)13(16(23)21-17)19-15(22)10-5-6-11(24-2)12(9-10)25-3/h5-6,9H,4,7-8H2,1-3H3,(H,19,22)(H3,18,20,21,23)