N-[6-azanyl-1-(2-methoxyethyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-methylsulfanyl-N-(phenylmethyl)pyridine-3-carboxamide

Systemtic Name: N-[6-azanyl-1-(2-methoxyethyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-methylsulfanyl-N-(phenylmethyl)pyridine-3-carboxamide Openeye Name: N-[6-amino-1-(2-methoxyethyl)-2,4-dioxo-pyrimidin-5-yl]-N-benzyl-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[6-amino-1-(2-methoxyethyl)-2,4-dioxo-5-pyrimidinyl]-2-(methylthio)-N-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: N-[6-amino-1-(2-methoxyethyl)-2,4-dioxopyrimidin-5-yl]-N-benzyl-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[6-amino-2,4-diketo-1-(2-methoxyethyl)pyrimidin-5-yl]-N-benzyl-2-(methylthio)nicotinamide Formula: C21H23N5O4S MolecularWeight: 441.50342

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SC)N

Isomeric SMILES

COCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)SC)N

InChI

InChI=1S/C21H23N5O4S/c1-30-12-11-25-17(22)16(18(27)24-21(25)29)26(13-14-7-4-3-5-8-14)20(28)15-9-6-10-23-19(15)31-2/h3-10H,11-13,22H2,1-2H3,(H,24,27,29)