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

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-5-bromanyl-N-butyl-2-chloranyl-benzamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-5-bromo-N-butyl-2-chloro-benzamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-5-bromo-N-butyl-2-chlorobenzamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-5-bromo-N-butyl-2-chlorobenzamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-5-bromo-N-butyl-2-chloro-benzamide Formula: C18H22BrClN4O3 MolecularWeight: 457.74928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C18H22BrClN4O3/c1-3-5-9-23(17(26)12-10-11(19)6-7-13(12)20)14-15(21)24(8-4-2)18(27)22-16(14)25/h6-7,10H,3-5,8-9,21H2,1-2H3,(H,22,25,27)