N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-methyl-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-methyl-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-methyl-2-[2-(2-thienyl)pyrrolidin-1-yl]acetamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-methyl-2-(2-thiophen-2-yl-1-pyrrolidinyl)acetamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-methyl-2-(2-thiophen-2-ylpyrrolidin-1-yl)acetamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-methyl-2-[2-(2-thienyl)pyrrolidino]acetamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CN3CCCC3C4=CC=CS4

Isomeric SMILES

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CN3CCCC3C4=CC=CS4

InChI

InChI=1S/C22H25N5O3S/c1-25(18(28)14-26-11-5-9-16(26)17-10-6-12-31-17)19-20(23)27(22(30)24-21(19)29)13-15-7-3-2-4-8-15/h2-4,6-8,10,12,16H,5,9,11,13-14,23H2,1H3,(H,24,29,30)