N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-iodanyl-N-methyl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-iodanyl-N-methyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-iodo-N-methyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-iodo-N-methylbenzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-iodo-N-methylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-iodo-N-methyl-benzamide Formula: C16H19IN4O3 MolecularWeight: 442.25153

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2=CC(=CC=C2)I)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2=CC(=CC=C2)I)N

InChI

InChI=1S/C16H19IN4O3/c1-3-4-8-21-13(18)12(14(22)19-16(21)24)20(2)15(23)10-6-5-7-11(17)9-10/h5-7,9H,3-4,8,18H2,1-2H3,(H,19,22,24)