N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-(2-methoxyethyl)-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-(2-methoxyethyl)-3-pyrrol-1-yl-benzamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-(2-methoxyethyl)-3-pyrrol-1-yl-benzamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-(2-methoxyethyl)-3-(1-pyrrolyl)benzamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-(2-methoxyethyl)-3-pyrrol-1-ylbenzamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-(2-methoxyethyl)-3-pyrrol-1-yl-benzamide Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC(=CC=C2)N3C=CC=C3)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC(=CC=C2)N3C=CC=C3)N

InChI

InChI=1S/C21H25N5O4/c1-3-9-26-18(22)17(19(27)23-21(26)29)25(12-13-30-2)20(28)15-7-6-8-16(14-15)24-10-4-5-11-24/h4-8,10-11,14H,3,9,12-13,22H2,1-2H3,(H,23,27,29)