N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-bromanyl-5-methoxy-N-methyl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-bromanyl-5-methoxy-N-methyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-bromo-5-methoxy-N-methyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-bromo-5-methoxy-N-methylbenzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-bromo-5-methoxy-N-methylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-bromo-5-methoxy-N-methyl-benzamide Formula: C17H21BrN4O4 MolecularWeight: 425.27704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2=C(C=CC(=C2)OC)Br)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2=C(C=CC(=C2)OC)Br)N

InChI

InChI=1S/C17H21BrN4O4/c1-4-5-8-22-14(19)13(15(23)20-17(22)25)21(2)16(24)11-9-10(26-3)6-7-12(11)18/h6-7,9H,4-5,8,19H2,1-3H3,(H,20,23,25)